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(1-Benzenesulfonyl-1H-pyrrol-3-yl)acetic acid, methyl ester
SpectraBase Compound ID kbvHmaUxQ4
InChI InChI=1S/C13H13NO4S/c1-18-13(15)9-11-7-8-14(10-11)19(16,17)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3
InChIKey YWWQOPBETNBRBV-UHFFFAOYSA-N
Mol Weight 279.31 g/mol
Molecular Formula C13H13NO4S
Exact Mass 279.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AFAHQPwmkiV
Name (1-BENZENESULFONYL-1H-PYRROL-3-YL)ACETIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13NO4S
InChI InChI=1S/C13H13NO4S/c1-18-13(15)9-11-7-8-14(10-11)19(16,17)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3
InChIKey YWWQOPBETNBRBV-UHFFFAOYSA-N
Molecular Weight 279.0562
SMILES c1c[n](S(=O)(=O)c2ccccc2)cc1CC(OC)=O
SPLASH splash10-004i-9130000000-2d2a216e0b8ff504379a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany