← Back to consensus flow objects
Amines, C36-alkylenedi-
| Flow Object ID | fo-616d0a7c785a3a95 | ||||||
|---|---|---|---|---|---|---|---|
| Type | Consensus | ||||||
| prefLabel |
|
||||||
| Alt Labels |
|
||||||
| CAS Numbers |
68955-56-6
|
||||||
| EC Numbers |
273-282-8
|
||||||
| Changes Applied | 26 |
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 29775d0e-02f3-4229-bbf8-375adbf1adac |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
PNJSUECMZCQDCC-ONBHPNORSA-N
|
| InChI |
InChI=1S/C72H139N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-71-73-72-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h23,25,29,31,42,44,48,50,73H,3-22,24,26-28,30,32-41,43,45-47,49,51-72H2,1-2H3/b25-23+,31-29+,44-42+,50-48+
|
| IUPAC name |
(12E,15E)-N-[(21E,24E)-hexatriaconta-21,24-dienyl]-1-hexatriaconta-12,15-dienamine, (12E,15E)-N-[(21E,24E)-hexatriaconta-21,24-dienyl]hexatriaconta-12,15-dien-1-amine, [(12E,15E)-hexatriaconta-12,15-dienyl]-[(21E,24E)-hexatriaconta-21,24-dienyl]amine
|
| Molecular formula |
C72H139N
|
| Molecular mass |
1018.911
|
| Monoisotopic mass |
1018.090753
|
| SMILES |
CCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCCCCCCCCCCNCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCCCCCCCCCC, CCCCCCCCCCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCNCCCCCCCCCCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCC, CCCCCCCCCCCCCCCCCCCCC=CCC=CCCCCCCCCCCCNCCCCCCCCCCCCCCCCCCCCC=CCC=CCCCCCCCCCCC
|
References
- https://commonchemistry.cas.org/detail?cas_rn=68955-56-6
- https://pubchem.ncbi.nlm.nih.gov/compound/6450357
- https://www.wikidata.org/wiki/Q76389800
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
f2b75791… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 4 | 2 |
2f9641b7… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
41a95b9a… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 4 | 2 |
29775d0e… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 4 | 2 |
638ef84f… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 2 |
c9e9b3d5… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 2 |
d555e482… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 4 | 2 |
49ed464a… |
EF 3.1 | kg | Environmental → Ground → Unknown | 4 | 2 |
2e1e8cda… |
EF 3.1 | kg | Environmental → Water → Ocean | 4 | 2 |
47c1ce16… |
EF 3.1 | kg | Environmental → Water → Surface water | 4 | 2 |
a343ddc2… |
EF 3.1 | kg | Environmental → Water → Unknown | 4 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
29775d0e… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
29775d0e… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
2e1e8cda… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
2e1e8cda… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
2f9641b7… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
2f9641b7… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
41a95b9a… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
41a95b9a… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
47c1ce16… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
47c1ce16… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
49ed464a… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
49ed464a… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
638ef84f… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
638ef84f… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
a343ddc2… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
a343ddc2… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
c9e9b3d5… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
c9e9b3d5… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
d555e482… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
d555e482… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
db7c9fd1… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
db7c9fd1… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
dec7e30b… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
dec7e30b… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
f2b75791… |
altLabel |
— |
[{"@value":"Amines, C<sub>36</sub>-alkylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:68955-56-6","https://commonchemistry.cas.org/detail?cas_rn=68955-56-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=68955-56-6; added Common Chemistry CAS names as altLabel: Amines, C<sub>36</sub>-alkylenedi-; object_uuid=fo-616d0a7c785a3a95 |
f2b75791… |
cas_match_labels |
— |
{"68955-56-6":"exactMatch"} |
group_key=amines,c36-alkylenedi-||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'68955-56-6': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-616d0a7c785a3a95: {'68955-56-6': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-616d0a7c785a3a95",
"prefLabel": [
{
"@value": "Amines, C36-alkylenedi-",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
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}
}
],
"altLabel": [
{
"@value": "Amines, C<sub>36</sub>-alkylenedi-",
"@language": "en",
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"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C72H139N"
],
"rdfs:label": "Molecular formula",
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},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
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"prov:hadPrimarySource": [
"CCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCCCCCCCCCCNCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCCCCCCCCCC"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"PNJSUECMZCQDCC-ONBHPNORSA-N"
],
"rdfs:label": "InChIKey",
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"prov:hadPrimarySource": [
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]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCCCCCCCCCCNCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCCCCCCCCCC",
"CCCCCCCCCCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCCNCCCCCCCCCCCCCCCCCCCC/C=C/C/C=C/CCCCCCCCCCC",
"CCCCCCCCCCCCCCCCCCCCC=CCC=CCCCCCCCCCCCNCCCCCCCCCCCCCCCCCCCCC=CCC=CCCCCCCCCCCC"
],
"rdfs:label": "SMILES",
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{
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"prov:hadPrimarySource": [
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},
{
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"prov:hadPrimarySource": [
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}
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},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C72H139N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-59-61-63-65-67-69-71-73-72-70-68-66-64-62-60-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h23,25,29,31,42,44,48,50,73H,3-22,24,26-28,30,32-41,43,45-47,49,51-72H2,1-2H3/b25-23+,31-29+,44-42+,50-48+"
],
"rdfs:label": "InChI",
"provenance": [
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],
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},
{
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"prov:hadPrimarySource": [
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]
}
]
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"(12E,15E)-N-[(21E,24E)-hexatriaconta-21,24-dienyl]-1-hexatriaconta-12,15-dienamine",
"(12E,15E)-N-[(21E,24E)-hexatriaconta-21,24-dienyl]hexatriaconta-12,15-dien-1-amine",
"[(12E,15E)-hexatriaconta-12,15-dienyl]-[(21E,24E)-hexatriaconta-21,24-dienyl]amine"
],
"rdfs:label": "IUPAC name",
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}
},
"https://w3id.org/chemrof/molecular_mass": {
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"rdfs:label": "Molecular mass",
"@value": [
"1018.911"
],
"provenance": [
{
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