For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzenesulfonic acid, 4-nitro-, [(4-methylphenyl)sulfonyl]methyl ester
SpectraBase Compound ID IOLJVySgbiN
InChI InChI=1S/C14H13NO7S2/c1-11-2-6-13(7-3-11)23(18,19)10-22-24(20,21)14-8-4-12(5-9-14)15(16)17/h2-9H,10H2,1H3
InChIKey YCZFYEXRDGVUNS-UHFFFAOYSA-N
Mol Weight 371.38 g/mol
Molecular Formula C14H13NO7S2
Exact Mass 371.013344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4mKu57bDGpv
Name Benzenesulfonic acid, 4-nitro-, [(4-methylphenyl)sulfonyl]methyl ester
CAS Registry Number 31081-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO7S2
InChI InChI=1S/C14H13NO7S2/c1-11-2-6-13(7-3-11)23(18,19)10-22-24(20,21)14-8-4-12(5-9-14)15(16)17/h2-9H,10H2,1H3
InChIKey YCZFYEXRDGVUNS-UHFFFAOYSA-N
Molecular Weight 371.378 g/mol
SMILES Cc1ccc(cc1)S(COS(c1ccc(cc1)N(=O)=O)(=O)=O)(=O)=O
SPLASH splash10-0a4u-5900000000-c2fd06a47ec9c04111c1
Source of Spectrum O-10-34-1
Synonyms [(4-Methylphenyl)sulfonyl]methyl 4-nitrobenzenesulfonate 4-Nitrobenzenesulfonic acid (4-methylphenyl)sulfonylmethyl ester 4-Nitrobenzenesulfonic acid tosylmethyl ester p-Tolylsulfonylmethyl 4-nitrobenzenesulfonate
Wiley ID 1354824