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Ammonium, (o-carboxyphenyl)trimethyl-, hydroxide, inner salt
SpectraBase Compound ID 5UL3JGOGSaU
InChI InChI=1S/C10H13NO2/c1-11(2,3)9-7-5-4-6-8(9)10(12)13/h4-7H,1-3H3
InChIKey VQEZQTQKSFAVLS-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJe5hlH33BQ
Name Ammonium, (o-carboxyphenyl)trimethyl-, hydroxide, inner salt
CAS Registry Number 21864-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-11(2,3)9-7-5-4-6-8(9)10(12)13/h4-7H,1-3H3
InChIKey VQEZQTQKSFAVLS-UHFFFAOYSA-N
Molecular Weight 179.219 g/mol
SMILES C[N+](C)(C)c1ccccc1C([O-])=O
SPLASH splash10-0035-5900000000-6c5e11cac31913b59404
Source of Spectrum O-7-628-1
Synonyms Benzenaminium, 2-carboxy-N,N,N-trimethyl-, hydroxide, inner salt 2-(Trimethylammonio)benzoate o-Benzbetaine
Wiley ID 1175199