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1H-Pyrrole-2-carboxylic acid, 3-[[[(4-methylphenyl)sulfonyl]amino]th io]-, methyl ester
SpectraBase Compound ID In9eZqdcb4m
InChI InChI=1S/C13H14N2O4S2/c1-9-3-5-10(6-4-9)21(17,18)15-20-11-7-8-14-12(11)13(16)19-2/h3-8,14-15H,1-2H3
InChIKey FYSZRIDCMHVMHF-UHFFFAOYSA-N
Mol Weight 326.39 g/mol
Molecular Formula C13H14N2O4S2
Exact Mass 326.039499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RKPqNwM6d3
Name 1H-Pyrrole-2-carboxylic acid, 3-[[[(4-methylphenyl)sulfonyl]amino]th io]-, methyl ester
Alternate Name(s) Methyl 3-({[(4-methylphenyl)sulfonyl]amino}sulfanyl)-1H-pyrrole-2-carboxylate Methyl 3-{[(4-methylphenyl)sulphonyl]amino}thio-pyrrole-2-carboxylate
CAS Registry Number 106230-23-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O4S2
InChI InChI=1S/C13H14N2O4S2/c1-9-3-5-10(6-4-9)21(17,18)15-20-11-7-8-14-12(11)13(16)19-2/h3-8,14-15H,1-2H3
InChIKey FYSZRIDCMHVMHF-UHFFFAOYSA-N
Molecular Weight 326.385 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)Sc1c(C(=O)OC)[nH]cc1
SPLASH splash10-00dl-5900000000-7c3465c1103fc6eb48ac
Source of Spectrum AH-117-272-7
Wiley ID 1324399