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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:167679 - garomefrine(1+)
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ChEBI Name
garomefrine(1+)
ChEBI ID
CHEBI:167679
Definition
A primary ammonium ion that is the conjugate acid of garomefrine, obtained from the protonation of the primary amino group. Major microspecies at pH 7.3.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C9H14FN2O3S
Net Charge
+1
Average Mass
249.280
Monoisotopic Mass
249.07037
InChI
InChI=1S/C9H13FN2O3S/c1-
16(14,15)
12-
6-
2-
3-
8(10)
7(4-
6)
9(13)
5-
11/h2-
4,9,12-
13H,5,11H2,1H3/p+1/t9-
/m0/s1
InChIKey
XYLJNMCMDOOJRW-VIFPVBQESA-O
SMILES
CS(=O)(=O)NC1=CC([C@@H](O)C[NH3+])=C(F)C=C1
ChEBI Ontology
Outgoing
garomefrine(1+) (
CHEBI:167679
)
is a
primary ammonium ion (
CHEBI:65296
)
garomefrine(1+) (
CHEBI:167679
)
is conjugate acid of
garomefrine (
CHEBI:167667
)
Incoming
garomefrine hydrochloride (
CHEBI:167680
)
has part
garomefrine(1+) (
CHEBI:167679
)
garomefrine (
CHEBI:167667
)
is conjugate base of
garomefrine(1+) (
CHEBI:167679
)
IUPAC Name
(2
R
)-2-{2-fluoro-5-[(methylsulfonyl)amino]phenyl}-2-hydroxyethanaminium
Synonym
Source
garomefrine cation
ChEBI
Last Modified
15 March 2021