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Benzene-1,4-diamine, 2-(4-methylphenylsulfonyl)-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Benzene-1,4-diamine, 2-(4-methylphenylsulfonyl)-
SpectraBase Compound ID I36YkPY8aBQ
InChI InChI=1S/C13H14N2O2S/c1-9-2-5-11(6-3-9)18(16,17)13-8-10(14)4-7-12(13)15/h2-8H,14-15H2,1H3
InChIKey OYOABUAQFRWPKI-UHFFFAOYSA-N
Mol Weight 262.33 g/mol
Molecular Formula C13H14N2O2S
Exact Mass 262.077599 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5jBUZVPbm05
Name Benzene-1,4-diamine, 2-(4-methylphenylsulfonyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.077598871 u
Formula C13H14N2O2S
InChI InChI=1S/C13H14N2O2S/c1-9-2-5-11(6-3-9)18(16,17)13-8-10(14)4-7-12(13)15/h2-8H,14-15H2,1H3
InChIKey OYOABUAQFRWPKI-UHFFFAOYSA-N
Molecular Weight 262.327 g/mol
SMILES CC1=CC=C(S(C2=CC(N)=CC=C2N)(=O)=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963607