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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:134915 - nicametate
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ChEBI Ontology
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ChEBI Name
nicametate
ChEBI ID
CHEBI:134915
Stars
This entity has been manually annotated by a third party.
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Formula
C12H18N2O2
Net Charge
0
Average Mass
222.284
Monoisotopic Mass
222.13683
InChI
InChI=1S/C12H18N2O2/c1-3-14(4-2)8-9-16-12(15)11-6-5-7-13-10-11/h5-7,10H,3-4,8-9H2,1-2H3
InChIKey
JVWOCHRRAWHKLT-UHFFFAOYSA-N
SMILES
C(OCCN(CC)CC)(=O)C=1C=CC=NC1
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
nicametate (
CHEBI:134915
)
is a
aromatic carboxylic acid (
CHEBI:33859
)
nicametate (
CHEBI:134915
)
is a
pyridines (
CHEBI:26421
)
Synonym
Source
beta-Diethylaminoethyl nicotinate
DrugCentral
Manual Xref
Database
3793
DrugCentral
View more database links
Registry Number
Type
Source
3099-52-3
CAS Registry Number
DrugCentral
Last Modified
23 February 2017