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

*Links on SpectraBase are not permalinks.
4-Acetyl-5-[(5-chloro-1H-indol-3-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester
SpectraBase Compound ID CxFcIjG33bi
InChI InChI=1S/C19H19ClN2O3/c1-4-25-19(24)18-10(2)17(11(3)23)16(22-18)7-12-9-21-15-6-5-13(20)8-14(12)15/h5-6,8-9,21-22H,4,7H2,1-3H3
InChIKey HYCDAKNPCYTLII-UHFFFAOYSA-N
Mol Weight 358.83 g/mol
Molecular Formula C19H19ClN2O3
Exact Mass 358.10842 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 KEvGraXtAjW
Name 4-Acetyl-5-[(5-chloro-1H-indol-3-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19ClN2O3
InChI InChI=1S/C19H19ClN2O3/c1-4-25-19(24)18-10(2)17(11(3)23)16(22-18)7-12-9-21-15-6-5-13(20)8-14(12)15/h5-6,8-9,21-22H,4,7H2,1-3H3
InChIKey HYCDAKNPCYTLII-UHFFFAOYSA-N
Molecular Weight 358.825 g/mol
SMILES [nH]1c(c(c(c1Cc1c[nH]c2c1cc(cc2)Cl)C(=O)C)C)C(=O)OCC
SPLASH splash10-0a4i-0059000000-f3933ce375bf009a620a
Source of Spectrum KC-0-1770-8
Synonyms Ethyl 4-acetyl-5-[(5-chloro-1H-indol-3-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylate Ethyl 5-[(5-chloranyl-1H-indol-3-yl)methyl]-4-ethanoyl-3-methyl-1H-pyrrole-2-carboxylate
Wiley ID 781383