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

*Links on SpectraBase are not permalinks.
1H-Indole-2-carboxylic acid, 5-methoxy-1-(2-oxopropyl)-3-(1H-pyrrol-1-yl)-
SpectraBase Compound ID IKm3IABfWES
InChI InChI=1S/C17H16N2O4/c1-11(20)10-19-14-6-5-12(23-2)9-13(14)15(16(19)17(21)22)18-7-3-4-8-18/h3-9H,10H2,1-2H3,(H,21,22)
InChIKey KRMKNXCYWJNFIF-UHFFFAOYSA-N
Mol Weight 312.33 g/mol
Molecular Formula C17H16N2O4
Exact Mass 312.111007 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 1i1EHSXaprq
Name 1H-Indole-2-carboxylic acid, 5-methoxy-1-(2-oxopropyl)-3-(1H-pyrrol-1-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O4
InChI InChI=1S/C17H16N2O4/c1-11(20)10-19-14-6-5-12(23-2)9-13(14)15(16(19)17(21)22)18-7-3-4-8-18/h3-9H,10H2,1-2H3,(H,21,22)
InChIKey KRMKNXCYWJNFIF-UHFFFAOYSA-N
Molecular Weight 312.325 g/mol
SMILES OC(c1[n](c2ccc(cc2c1-[n]1cccc1)OC)CC(=O)C)=O
SPLASH splash10-000x-5930000000-eee4731539b746372837
Source of Spectrum IY-1-4314-8
Synonyms 5-Methoxy-1-(2-oxopropyl)-3-(1-pyrrolyl)-2-indolecarboxylic acid 5-Methoxy-1-(2-oxopropyl)-3-pyrrol-1-ylindole-2-carboxylic acid 5-Methoxy-1-(2-oxidanylidenepropyl)-3-pyrrol-1-yl-indole-2-carboxylic acid
Wiley ID 1651131