2-amino-2,3-dimethylbutanenitrile

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2-amino-2,3-dimethylbutanenitrile

UUID a4ddf7f5-0f92-4bba-8274-37f6087ba095

Flow Object ID fo-fdd1d7cb16c366e7

Source EF 3.1

Context Environmental → Air → Unknown

CAS Numbers 13893-53-3

EC Numbers 604-102-1

prefLabel

Language	Value	Provenance
`en`	`2-amino-2,3-dimethylbutanenitrile`

altLabel ⓘ

Language	Value	Provenance
`en`	`(±)-2-Amino-2,3-dimethylbutyronitrile`
`en`	`(±)-2-Amino-2-cyano-3-methylbutane`
`en`	`2-Amino-2,3-dimethylbutyronitrile`
`en`	`AC 94149`
`en`	`Butanenitrile, 2-amino-2,3-dimethyl-`
`en`	`Butyronitrile, 2-amino-2,3-dimethyl-`

References

Shared Properties

Predicate	Value
InChIKey	`CAOHBROWLMCZRP-UHFFFAOYSA-N, RLNLIVBLEZDLMZ-UHFFFAOYSA-N`
InChI	`InChI=1S/C13H12N4O2S/c14-10-2-5-12(6-3-10)20(18,19)17-11-4-1-9-8-15-16-13(9)7-11/h1-8,17H,14H2,(H,15,16), InChI=1S/C6H12N2/c1-5(2)6(3,8)4-7/h5H,8H2,1-3H3`
IUPAC name	`2-amino-2,3-dimethyl-butanenitrile, 2-amino-2,3-dimethyl-butyronitrile, 2-amino-2,3-dimethylbutanenitrile, 2-azanyl-2,3-dimethyl-butanenitrile, 4-amino-N-(1H-indazol-6-yl)benzenesulfonamide, 4-azanyl-N-(1H-indazol-6-yl)benzenesulfonamide`
Molecular formula	`C13H12N4O2S, C6H12N2`
SMILES	`C1=CC(=CC=C1N)S(=O)(=O)NC2=CC3=C(C=C2)C=NN3, CC(C)C(C)(C#N)N`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`a4ddf7f5-0f92-4bba-8274-37f6087ba095`	2-amino-2,3-dimethylbutanenitrile

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	2-amino-2,3-dimethylbutanenitrile	Emissions/Emissions to air/Emissions to air, indoor	kg	`exactMatch`	—

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=2-amino-2,3-dimethylbutanenitrile\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=13893-53-3; added Common Chemistry CAS names as altLabel: (±)-2-Amino-2,3-dimethylbutyronitrile, (±)-2-Amino-2-cyano-3-methylbutane, 2-Amino-2,3-dimethylbutyronitrile, AC 94149, Butanenitrile, 2-amino-2,3-dimethyl-, Butyronitrile, 2-amino-2,3-dimethyl-; object_uuid=fo-fdd1d7cb16c366e7
`cas_match_labels`	1	`—`	consensus_match	group_key=2-amino-2,3-dimethylbutanenitrile\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'13893-53-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fdd1d7cb16c366e7: {'13893-53-3': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
indoor	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '(±)-2-Amino-2,3-dimethylbutyronitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:13893-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=13893-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(±)-2-Amino-2-cyano-3-methylbutane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:13893-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=13893-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Amino-2,3-dimethylbutyronitrile', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:13893-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=13893-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'AC 94149', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:13893-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=13893-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butanenitrile, 2-amino-2,3-dimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:13893-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=13893-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyronitrile, 2-amino-2,3-dimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:13893-53-3', 'https://commonchemistry.cas.org/detail?cas_rn=13893-53-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=2-amino-2,3-dimethylbutanenitrile\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=13893-53-3; added Common Chemistry CAS names as altLabel: (±)-2-Amino-2,3-dimethylbutyronitrile, (±)-2-Amino-2-cyano-3-methylbutane, 2-Amino-2,3-dimethylbutyronitrile, AC 94149, Butanenitrile, 2-amino-2,3-dimethyl-, Butyronitrile, 2-amino-2,3-dimethyl-; object_uuid=fo-fdd1d7cb16c366e7
`cas_match_labels`	`None`	`{'13893-53-3': 'exactMatch'}`	group_key=2-amino-2,3-dimethylbutanenitrile\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'13893-53-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-fdd1d7cb16c366e7: {'13893-53-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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