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N-(p-Tolylsulfonyl)-1,8-naphthosultam
SpectraBase Compound ID JwzO5Mo4Xmq
InChI InChI=1S/C17H13NO4S2/c1-12-8-10-14(11-9-12)23(19,20)18-15-6-2-4-13-5-3-7-16(17(13)15)24(18,21)22/h2-11H,1H3
InChIKey PMABUSRQMPUODS-UHFFFAOYSA-N
Mol Weight 359.41 g/mol
Molecular Formula C17H13NO4S2
Exact Mass 359.0286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOtXi2Fh1KB
Name N-(p-Tolylsulfonyl)-1,8-naphthosultam
Alternate Name(s) 2-[(4-methylphenyl)sulfonyl]-2H-naphtho[1,8-cd]isothiazole 1,1-dioxide
CAS Registry Number 109593-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO4S2
InChI InChI=1S/C17H13NO4S2/c1-12-8-10-14(11-9-12)23(19,20)18-15-6-2-4-13-5-3-7-16(17(13)15)24(18,21)22/h2-11H,1H3
InChIKey PMABUSRQMPUODS-UHFFFAOYSA-N
Molecular Weight 359.414 g/mol
SMILES c1(S(N2S(c3c4c(cccc24)ccc3)(=O)=O)(=O)=O)ccc(cc1)C
SPLASH splash10-0a4o-7900000000-b4463d190ed460ea2c76
Source of Spectrum J-56-6515-12
Wiley ID 1347679