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N-[4-(6-Methyl-1,3-benzothiazol-2-yl)phenyl]-3-nitrobenzenesulfonamide
SpectraBase Compound ID 3Yc9wK7JPo7
InChI InChI=1S/C20H15N3O4S2/c1-13-5-10-18-19(11-13)28-20(21-18)14-6-8-15(9-7-14)22-29(26,27)17-4-2-3-16(12-17)23(24)25/h2-12,22H,1H3
InChIKey KLRLNBSHFXCAKN-UHFFFAOYSA-N
Mol Weight 425.48 g/mol
Molecular Formula C20H15N3O4S2
Exact Mass 425.050398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTCnxC8zDFI
Name N-[4-(6-METHYL-2-BENZOTHIAZOLYL)PHENYL]-3-NITROBENZENESULFONAMIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H15N3O4S2
InChI InChI=1S/C20H15N3O4S2/c1-13-5-10-18-19(11-13)28-20(21-18)14-6-8-15(9-7-14)22-29(26,27)17-4-2-3-16(12-17)23(24)25/h2-12,22H,1H3
InChIKey KLRLNBSHFXCAKN-UHFFFAOYSA-N
Molecular Weight 425.0501
SMILES N(S(c1cccc(N(=O)=O)c1)(=O)=O)c1ccc(cc1)-c1sc2cc(C)ccc2n1
SPLASH splash10-000i-5490200000-5a9bdeae2d3aa117e398
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany