For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-Indole-2-carboxylic acid, 3-hydroxy-1-methyl-, ethyl ester
SpectraBase Compound ID 32qGCDuyix5
InChI InChI=1S/C12H13NO3/c1-3-16-12(15)10-11(14)8-6-4-5-7-9(8)13(10)2/h4-7,14H,3H2,1-2H3
InChIKey WCYURHXDMXGKQD-UHFFFAOYSA-N
Mol Weight 219.24 g/mol
Molecular Formula C12H13NO3
Exact Mass 219.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8uS75IWVMKR
Name 1H-Indole-2-carboxylic acid, 3-hydroxy-1-methyl-, ethyl ester
Alternate Name(s) Ethyl 3-hydroxy-1-methylindole-2-carboxylate 3-Hydroxy-1-methyl-2-indolecarboxylic acid ethyl ester Ethyl 3-hydroxy-1-methyl-indole-2-carboxylate Ethyl 1-methyl-3-oxidanyl-indole-2-carboxylate
CAS Registry Number 42871-90-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO3
InChI InChI=1S/C12H13NO3/c1-3-16-12(15)10-11(14)8-6-4-5-7-9(8)13(10)2/h4-7,14H,3H2,1-2H3
InChIKey WCYURHXDMXGKQD-UHFFFAOYSA-N
Molecular Weight 219.240 g/mol
SMILES Oc1c([n](c2ccccc12)C)C(=O)OCC
SPLASH splash10-01b9-2910000000-20d73a7886ed8d395aba
Source of Spectrum KC-1983-2222-0
Wiley ID 1218808