← Back to consensus flow objects
Menthane, Monohydroperoxy Derivative
| Flow Object ID | fo-f92412c64087bdbe | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Type | Consensus | |||||||||
| prefLabel |
|
|||||||||
| Alt Labels |
|
|||||||||
| CAS Numbers |
26762-92-5
|
|||||||||
| EC Numbers |
247-987-6
|
|||||||||
| Changes Applied | 26 |
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 0247e4c9-3552-4ccc-adfc-dcc0ceb76521 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
OZTWDFWAMMUDHQ-GUBZILKMSA-N, OZTWDFWAMMUDHQ-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C10H20O2/c1-7(2)9-5-4-8(3)6-10(9)12-11/h7-11H,4-6H2,1-3H3, InChI=1S/C10H20O2/c1-7(2)9-5-4-8(3)6-10(9)12-11/h7-11H,4-6H2,1-3H3/t8-,9-,10-/m0/s1
|
| IUPAC name |
(1S,2S,4S)-2-(dioxidanyl)-4-methyl-1-propan-2-yl-cyclohexane, (1S,2S,4S)-2-hydroperoxy-1-isopropyl-4-methyl-cyclohexane, (1S,2S,4S)-2-hydroperoxy-4-methyl-1-propan-2-ylcyclohexane, 2-(dioxidanyl)-4-methyl-1-propan-2-yl-cyclohexane, 2-hydroperoxy-1-isopropyl-4-methyl-cyclohexane, 2-hydroperoxy-4-methyl-1-propan-2-ylcyclohexane
|
| Molecular formula |
C10H20O2
|
| Molecular mass |
172.268
|
| Monoisotopic mass |
172.14633
|
| SMILES |
CC1CCC(C(C)C)C(OO)C1, CC1CCC(C(C1)OO)C(C)C, C[C@H]1CC[C@H]([C@H](C1)OO)C(C)C
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J156.179K
- https://chem.echa.europa.eu/100.043.610
- https://chem.echa.europa.eu/100.048.786
- https://chem.echa.europa.eu/100.049.655
- https://commonchemistry.cas.org/detail?cas_rn=26762-92-5
- https://commonchemistry.cas.org/detail?cas_rn=37837-09-5
- https://commonchemistry.cas.org/detail?cas_rn=39811-34-2
- https://comptox.epa.gov/dashboard/DTXSID40865317
- https://pubchem.ncbi.nlm.nih.gov/compound/117329
- https://pubchem.ncbi.nlm.nih.gov/compound/99123364
- https://www.wikidata.org/wiki/Q15634273
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
4b8417be… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 2 |
db22b2c4… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
f5fd7962… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 2 |
e49fefe6… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 2 |
0247e4c9… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
b6f8c47d… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
5e234517… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 2 |
1fcfbf54… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 2 |
53af0c35… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 2 |
0d3ac58d… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 2 |
d7ea8231… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
0247e4c9… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
0247e4c9… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
0d3ac58d… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
0d3ac58d… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
1fcfbf54… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
1fcfbf54… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
2d5529ab… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
2d5529ab… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
4b8417be… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
4b8417be… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
53af0c35… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
53af0c35… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
5e234517… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
5e234517… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
b6f8c47d… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
b6f8c47d… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
d7ea8231… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
d7ea8231… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
db22b2c4… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
db22b2c4… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
e49fefe6… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
e49fefe6… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
efeb3008… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
efeb3008… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
f5fd7962… |
altLabel |
— |
[{"@value":"<em>p</em>-Menthyl hydroperoxide","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:26762-92-5","https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; cas=26762-92-5; added Common Chemistry CAS names as altLabel: <em>p</em>-Menthyl hydroperoxide, Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.; object_uuid=fo-f92412c64087bdbe |
f5fd7962… |
cas_match_labels |
— |
{"26762-92-5":"exactMatch"} |
group_key=menthane,monohydroperoxyderivative||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'26762-92-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f92412c64087bdbe: {'26762-92-5': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-f92412c64087bdbe",
"prefLabel": [
{
"@value": "Menthane, Monohydroperoxy Derivative",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
"@value": "<em>p</em>-Menthyl hydroperoxide",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
},
{
"@value": "Cyclohexane, 1-methyl-4-(1-methylethyl)-, monohydroperoxy deriv.",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C10H20O2"
],
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329",
"CID:99123364"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C)C)C(OO)C1"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"OZTWDFWAMMUDHQ-GUBZILKMSA-N",
"OZTWDFWAMMUDHQ-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329",
"CID:99123364"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C)C)C(OO)C1"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CC1CCC(C(C)C)C(OO)C1",
"CC1CCC(C(C1)OO)C(C)C",
"C[C@H]1CC[C@H]([C@H](C1)OO)C(C)C"
],
"rdfs:label": "SMILES",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329",
"CID:99123364"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
},
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C1)OO)C(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C)C)C(OO)C1"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C10H20O2/c1-7(2)9-5-4-8(3)6-10(9)12-11/h7-11H,4-6H2,1-3H3",
"InChI=1S/C10H20O2/c1-7(2)9-5-4-8(3)6-10(9)12-11/h7-11H,4-6H2,1-3H3/t8-,9-,10-/m0/s1"
],
"rdfs:label": "InChI",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329",
"CID:99123364"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C)C)C(OO)C1"
]
}
]
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"(1S,2S,4S)-2-(dioxidanyl)-4-methyl-1-propan-2-yl-cyclohexane",
"(1S,2S,4S)-2-hydroperoxy-1-isopropyl-4-methyl-cyclohexane",
"(1S,2S,4S)-2-hydroperoxy-4-methyl-1-propan-2-ylcyclohexane",
"2-(dioxidanyl)-4-methyl-1-propan-2-yl-cyclohexane",
"2-hydroperoxy-1-isopropyl-4-methyl-cyclohexane",
"2-hydroperoxy-4-methyl-1-propan-2-ylcyclohexane"
],
"rdfs:label": "IUPAC name",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329",
"CID:99123364"
],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
"172.268"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C1)OO)C(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C)C)C(OO)C1"
]
}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
"172.14633"
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C1)OO)C(C)C"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CC1CCC(C(C)C)C(OO)C1"
]
}
],
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J156.179K",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.043.610",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.048.786",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.049.655",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=26762-92-5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"26762-92-5"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=37837-09-5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=39811-34-2",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID40865317",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/117329",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[26762-92-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/99123364",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:99123364;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[26762-92-5]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q15634273",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:117329;CAS:26762-92-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[26762-92-5]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "0247e4c9-3552-4ccc-adfc-dcc0ceb76521",
"seed_source": "EF 3.1"
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"26762-92-5"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"
],
"skos:exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=26762-92-5"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"247-987-6"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=247-987-6"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null
}