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P-toluenesulfonamide
SpectraBase Compound ID 1sFKzIsKrkV
InChI InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)
InChIKey LMYRWZFENFIFIT-UHFFFAOYSA-N
Mol Weight 171.21 g/mol
Molecular Formula C7H9NO2S
Exact Mass 171.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHzRTuxb7Eu
Name Tolbutamide-A (-C8H17NO)
CAS Registry Number 70-55-3
Classification Pharmaceutical drug artifact
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 171.035399706 u
Formula C7H9NO2S
InChI InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)
InChIKey LMYRWZFENFIFIT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 171.214 g/mol
Nominal Mass 171 u
Quality 979
Retention Index 1324
SMILES C1(S(N)(=O)=O)=CC=C(C=C1)C
SPLASH splash10-052f-9300000000-0aa46a5ed0ba09065367
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Methylbenzenesulfonamide
Technique GC/MS
Wiley ID DD2024_011578