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Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-, Acetate (1:1)

2D structure
UUID 25ea530d-7ee8-4e52-be3d-712bd48f0fcf
Flow Object IDfo-f11bfd1f5b8c18ec
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 41272-40-6
EC Numbers 255-288-2
prefLabel
Language Value Provenance
en Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-, Acetate (1:1)
altLabel
Language Value Provenance
en Malachite green acetate
en Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate
en Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate (1:1)
References
Shared Properties
Predicate Value
InChIKey JORAGBAOOQINIM-UHFFFAOYSA-N, LXHOGENDFZKPSF-UHFFFAOYSA-N, VPJMOSKUCQUJHU-UHFFFAOYSA-M, WZQBRQMVLLLQII-UHFFFAOYSA-M
InChI InChI=1S/C23H25N2.C2H4O2/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4;1-2(3)4/h5-17H,1-4H3;1H3,(H,3,4)/q+1;/p-1
IUPAC name Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-, Acetate (1:1)
Molecular formula C23H26N2O, C25H28N2O2, C27H35N3O4, C31H58ClNO2
Molecular mass 388.511, 465.594
Monoisotopic mass 388.215078, 465.262757
SMILES CC(=O)[O-].CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccccc2)cc1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 25ea530d-7ee8-4e52-be3d-712bd48f0fcf methanaminium, n-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-, acetate (1:1)

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 methanaminium, n-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-, acetate (1:1) Emissions/Emissions to soil/Emissions to non-agricultural soil 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=methanaminium,n-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-,acetate(1:1)||dimension=Environmental > media=Air > strata=Unknown; cas=41272-40-6; added Common Chemistry CAS names as altLabel: Malachite green acetate, Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate, Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate (1:1); object_uuid=fo-f11bfd1f5b8c18ec
cas_match_labels 1 consensus_match group_key=methanaminium,n-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-,acetate(1:1)||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'41272-40-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f11bfd1f5b8c18ec: {'41272-40-6': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Malachite green acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:41272-40-6', 'https://commonchemistry.cas.org/detail?cas_rn=41272-40-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:41272-40-6', 'https://commonchemistry.cas.org/detail?cas_rn=41272-40-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:41272-40-6', 'https://commonchemistry.cas.org/detail?cas_rn=41272-40-6'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=methanaminium,n-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-,acetate(1:1)||dimension=Environmental > media=Air > strata=Unknown; cas=41272-40-6; added Common Chemistry CAS names as altLabel: Malachite green acetate, Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate, Methanaminium, <em>N</em>-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-<em>N</em>-methyl-, acetate (1:1); object_uuid=fo-f11bfd1f5b8c18ec
cas_match_labels None {'41272-40-6': 'exactMatch'} group_key=methanaminium,n-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-n-methyl-,acetate(1:1)||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'41272-40-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f11bfd1f5b8c18ec: {'41272-40-6': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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