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Methyl 1-methyl-3-phenyl-2-phenlthio-4-pyrrolecarboxylate
SpectraBase Compound ID IY2FLJctiE4
InChI InChI=1S/C19H17NO2S/c1-20-13-16(19(21)22-2)17(14-9-5-3-6-10-14)18(20)23-15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey QUJSKCDOAOAKPB-UHFFFAOYSA-N
Mol Weight 323.41 g/mol
Molecular Formula C19H17NO2S
Exact Mass 323.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KAYkTGAD7O
Name Methyl 1-methyl-3-phenyl-2-phenlthio-4-pyrrolecarboxylate
Alternate Name(s) Methyl 1-methyl-4-phenyl-5-(phenylsulfanyl)-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17NO2S
InChI InChI=1S/C19H17NO2S/c1-20-13-16(19(21)22-2)17(14-9-5-3-6-10-14)18(20)23-15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKey QUJSKCDOAOAKPB-UHFFFAOYSA-N
Molecular Weight 323.410 g/mol
SMILES c1(c(c(Sc2ccccc2)[n](c1)C)-c1ccccc1)C(=O)OC
SPLASH splash10-01qa-0942000000-2e6378d152a872840a2c
Source of Spectrum F-50-109-0
Wiley ID 1322485