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Isobutyl Nitrite

UUID 5885178e-50f7-4d99-951b-be57eeb0c957
Deprecated yes
Replaced By cd50ad99-3ea5-4a95-8ae8-868703a8476d
Flow Object IDfo-fb0a2872526d7d84
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 542-56-3
EC Numbers 208-819-7
prefLabel
Language Value Provenance
en Isobutyl Nitrite
altLabel ⓘ
Language Value Provenance
en 2-methylpropyl nitrite
en IBN
en Isobutylnitrit
en nitrous acid, 2-methylpropyl ester
en nitrous acid, isobutyl ester
en <em>iso</em>-Butyl nitrite
en Blackjack
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey APNSGVMLAYLYCT-UHFFFAOYSA-N
InChI InChI=1S/C4H9NO2/c1-4(2)3-7-5-6/h4H,3H2,1-2H3
IUPAC name 2-methylpropyl nitrite, isobutyl nitrite, nitrous acid 2-methylpropyl ester, nitrous acid isobutyl ester
Molecular formula C4H9NO2
Molecular mass 103.121
Monoisotopic mass 103.06333
SMILES CC(C)CON=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 5885178e-50f7-4d99-951b-be57eeb0c957 isobutyl nitrite

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=isobutylnitrite||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=542-56-3; added Common Chemistry CAS names as altLabel: <em>iso</em>-Butyl nitrite, Blackjack; object_uuid=fo-fb0a2872526d7d84
cas_match_labels 1 — consensus_match group_key=isobutylnitrite||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'542-56-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fb0a2872526d7d84: {'542-56-3': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '2-methylpropyl nitrite', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylpropyl nitrite', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'IBN', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:IBN', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Isobutylnitrit', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Isobutylnitrit', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'nitrous acid, 2-methylpropyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:nitrous acid, 2-methylpropyl ester', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'nitrous acid, isobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:nitrous acid, isobutyl ester', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '2-methylpropyl nitrite', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-methylpropyl nitrite', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'IBN', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:IBN', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Isobutylnitrit', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Isobutylnitrit', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'nitrous acid, 2-methylpropyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:nitrous acid, 2-methylpropyl ester', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'nitrous acid, isobutyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:nitrous acid, isobutyl ester', 'http://purl.obolibrary.org/obo/CHEBI_46643', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '<em>iso</em>-Butyl nitrite', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:542-56-3', 'https://commonchemistry.cas.org/detail?cas_rn=542-56-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Blackjack', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:542-56-3', 'https://commonchemistry.cas.org/detail?cas_rn=542-56-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=isobutylnitrite||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); cas=542-56-3; added Common Chemistry CAS names as altLabel: <em>iso</em>-Butyl nitrite, Blackjack; object_uuid=fo-fb0a2872526d7d84
cas_match_labels None {'542-56-3': 'exactMatch'} group_key=isobutylnitrite||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'542-56-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fb0a2872526d7d84: {'542-56-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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