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2-(1-Ethyl-2-formyl-3-indolyl)acetic acid
SpectraBase Compound ID TbrYNuhw2N
InChI InChI=1S/C13H13NO3/c1-2-14-11-6-4-3-5-9(11)10(7-13(16)17)12(14)8-15/h3-6,8H,2,7H2,1H3,(H,16,17)
InChIKey ZZESICRXSGTPQW-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGPDQKCohRl
Name 2-(1-Ethyl-2-formyl-3-indolyl)acetic acid
CAS Registry Number 126775-01-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-2-14-11-6-4-3-5-9(11)10(7-13(16)17)12(14)8-15/h3-6,8H,2,7H2,1H3,(H,16,17)
InChIKey ZZESICRXSGTPQW-UHFFFAOYSA-N
Molecular Weight 231.251 g/mol
SMILES OC(Cc1c([n](CC)c2c1cccc2)C=O)=O
SPLASH splash10-000i-0940000000-81c61858355bc0c2d925
Source of Spectrum F-45-6768-0
Synonyms 2-(1-Ethyl-2-formyl-indol-3-yl)acetic acid 2-(1-Ethyl-2-methanoyl-indol-3-yl)ethanoic acid
Wiley ID 1232763