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4-(2-Chloro-1H-indol-3-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester
SpectraBase Compound ID 22bsOyhpU4p
InChI InChI=1S/C17H17ClN2O2/c1-4-22-17(21)14-10(3)19-9(2)13(14)15-11-7-5-6-8-12(11)20-16(15)18/h5-8,19-20H,4H2,1-3H3
InChIKey PPHQLGGWXDGJFY-UHFFFAOYSA-N
Mol Weight 316.79 g/mol
Molecular Formula C17H17ClN2O2
Exact Mass 316.097855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UpDVQH8qYt
Name 4-(2-Chloro-1H-indol-3-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 4-(2-chloro-1H-indol-3-yl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN2O2
InChI InChI=1S/C17H17ClN2O2/c1-4-22-17(21)14-10(3)19-9(2)13(14)15-11-7-5-6-8-12(11)20-16(15)18/h5-8,19-20H,4H2,1-3H3
InChIKey PPHQLGGWXDGJFY-UHFFFAOYSA-N
Molecular Weight 316.788 g/mol
SMILES [nH]1c(c(-c2c([nH]c3ccccc23)Cl)c(c1C)C(=O)OCC)C
SPLASH splash10-0uxr-0093000000-e379ce8268e97a555197
Source of Spectrum KC-61-3122-17
Wiley ID 1628374