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3,6-dihydro-2-nitroso-2h-1,2-oxazine
| Flow Object ID | fo-84cf3d94ebc439e4 | ||||
|---|---|---|---|---|---|
| Type | Consensus | ||||
| prefLabel |
|
||||
| CAS Numbers | 3276-41-3 | ||||
| Changes Applied | 13 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
JRIFTVNYAPUKTK-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C4H6N2O2/c7-5-6-3-1-2-4-8-6/h1-2H,3-4H2
|
| IUPAC name |
2-nitroso-3,6-dihydro-1,2-oxazine, 2-nitroso-3,6-dihydrooxazine
|
| Molecular formula |
C4H6N2O2
|
| SMILES |
C1C=CCON1N=O
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.513J
- https://commonchemistry.cas.org/detail?cas_rn=3276-41-3
- https://comptox.epa.gov/dashboard/DTXSID7020473
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/GM4KT4UK89
- https://pubchem.ncbi.nlm.nih.gov/compound/76762
- https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL166180
- https://www.wikidata.org/wiki/Q63088187
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
1f317287… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 1 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 1 |
fe0acd60… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 1 |
fe0acd60… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 1 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 1 |
9763edfa… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 1 |
4d9a8790… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 1 |
4d9a8790… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 1 |
fe0acd60… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 1 |
fe0acd60… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 1 |
fe0acd60… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 1 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
1f317287… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
4d9a8790… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
4d9a8790… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
4d9a8790… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
4d9a8790… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
9763edfa… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
fe0acd60… |
cas_match_labels |
— |
{"3276-41-3":"exactMatch"} |
group_key=3,6-dihydro-2-nitroso-2h-1,2-oxazine||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'3276-41-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-84cf3d94ebc439e4: {'3276-41-3': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-84cf3d94ebc439e4",
"prefLabel": [
{
"@value": "3,6-dihydro-2-nitroso-2h-1,2-oxazine",
"@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": [],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C4H6N2O2"
],
"rdfs:label": "Molecular formula",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:76762"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"JRIFTVNYAPUKTK-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": {
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"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
}
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"C1C=CCON1N=O"
],
"rdfs:label": "SMILES",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:76762"
],
"prov:wasDerivedFrom": "pubchem.props.SMILES"
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C4H6N2O2/c7-5-6-3-1-2-4-8-6/h1-2H,3-4H2"
],
"rdfs:label": "InChI",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:76762"
],
"prov:wasDerivedFrom": "pubchem.props.InChI"
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"2-nitroso-3,6-dihydro-1,2-oxazine",
"2-nitroso-3,6-dihydrooxazine"
],
"rdfs:label": "IUPAC name",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:76762"
],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J34.513J",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:76762;CAS:3276-41-3"
],
"prov:wasDerivedFrom": "pubchem.identifiers[3276-41-3]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=3276-41-3",
"provenance": {
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],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID7020473",
"provenance": {
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],
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}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/GM4KT4UK89",
"provenance": {
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],
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}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/76762",
"provenance": {
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],
"prov:wasDerivedFrom": "pubchem.by_cas[3276-41-3]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL166180",
"provenance": {
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],
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}
},
{
"@id": "https://www.wikidata.org/wiki/Q63088187",
"provenance": {
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"CID:76762;CAS:3276-41-3"
],
"prov:wasDerivedFrom": "pubchem.identifiers[3276-41-3]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "1f317287-6556-11dd-ad8b-0800200c9a66",
"seed_source": "EF 3.1"
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"3276-41-3"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=3276-41-3"
],
"skos:exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=3276-41-3"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null
}