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Nicotine sulfate

UUID 8926a402-fc30-4adf-bafc-71b2bd0f3de1
Flow Object IDfo-e6a4cf458af75b8d
Source EF 3.1
Context Environmental → Ground → Agricultural
CAS Numbers 65-30-5
EC Numbers 200-606-7
prefLabel ⓘ
Language Value Provenance
en Nicotine sulfate
altLabel ⓘ
Language Value Provenance
en Black Leaf 40
en Nicotine, sulfate (2:1)
en Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (<em>S</em>)-, sulfate (2:1)
en Pyridine, 3-[(2<em>S</em>)-1-methyl-2-pyrrolidinyl]-, sulfate (2:1)
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey IECQULMJVNSKDB-RCWTXCDDSA-N
InChI InChI=1S/2C10H14N2.H2O4S/c2*1-12-7-3-5-10(12)9-4-2-6-11-8-9;1-5(2,3)4/h2*2,4,6,8,10H,3,5,7H2,1H3;(H2,1,2,3,4)/t2*10-;/m00./s1
IUPAC name bis(3-[(2S)-1-methyl-2-pyrrolidinyl]pyridine);sulfuric acid, bis(3-[(2S)-1-methylpyrrolidin-2-yl]pyridine);sulfuric acid
Molecular formula 2C10H14N2.H2O4S, C20H30N4O4S
Molecular mass 422.551
Monoisotopic mass 422.19878
SMILES CN1CCCC1C2=CN=CC=C2.CN1CCCC1C2=CN=CC=C2.OS(=O)(=O)O, CN1CCC[C@H]1C2=CN=CC=C2.CN1CCC[C@H]1C2=CN=CC=C2.OS(=O)(=O)O, O=S(=O)(O)O.[H][C@@]1(c2cccnc2)CCCN1C.[H][C@@]1(c2cccnc2)CCCN1C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 8926a402-fc30-4adf-bafc-71b2bd0f3de1 nicotine sulphate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 nicotine sulphate Emissions/Emissions to soil/Emissions to 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 2 — consensus_match group_key=nicotinesulphate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=65-30-5; added Common Chemistry CAS names as altLabel: Black Leaf 40, Nicotine, sulfate (2:1), Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (<em>S</em>)-, sulfate (2:1), Pyridine, 3-[(2<em>S</em>)-1-methyl-2-pyrrolidinyl]-, sulfate (2:1); object_uuid=fo-e6a4cf458af75b8d
cas_match_labels 1 — consensus_match group_key=nicotinesulphate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'65-30-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e6a4cf458af75b8d: {'65-30-5': 'exactMatch'}
prefLabel 1 — consensus_match cas=65-30-5; cc_chebi_agreed_name='Nicotine sulfate'; object_uuid=fo-e6a4cf458af75b8d

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyAgricultural

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Nicotine Sulphate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Nicotine sulfate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65-30-5'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=65-30-5; cc_chebi_agreed_name='Nicotine sulfate'; object_uuid=fo-e6a4cf458af75b8d
altLabel None [{'@value': 'Nicotine Sulphate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=65-30-5; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-e6a4cf458af75b8d
altLabel [{'@value': 'Nicotine Sulphate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': 'Black Leaf 40', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65-30-5', 'https://commonchemistry.cas.org/detail?cas_rn=65-30-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Nicotine, sulfate (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65-30-5', 'https://commonchemistry.cas.org/detail?cas_rn=65-30-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (<em>S</em>)-, sulfate (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65-30-5', 'https://commonchemistry.cas.org/detail?cas_rn=65-30-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pyridine, 3-[(2<em>S</em>)-1-methyl-2-pyrrolidinyl]-, sulfate (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:65-30-5', 'https://commonchemistry.cas.org/detail?cas_rn=65-30-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=nicotinesulphate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=65-30-5; added Common Chemistry CAS names as altLabel: Black Leaf 40, Nicotine, sulfate (2:1), Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (<em>S</em>)-, sulfate (2:1), Pyridine, 3-[(2<em>S</em>)-1-methyl-2-pyrrolidinyl]-, sulfate (2:1); object_uuid=fo-e6a4cf458af75b8d
cas_match_labels None {'65-30-5': 'exactMatch'} group_key=nicotinesulphate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'65-30-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e6a4cf458af75b8d: {'65-30-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "unit": "kg",
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