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Methanol, [(4-nitrophenyl)sulfonyl]-, 4-methylbenzenesulfonate
SpectraBase Compound ID LjOOBnzxAST
InChI InChI=1S/C14H13NO7S2/c1-11-2-6-14(7-3-11)24(20,21)22-10-23(18,19)13-8-4-12(5-9-13)15(16)17/h2-9H,10H2,1H3
InChIKey NBZIWHFDDGNMEZ-UHFFFAOYSA-N
Mol Weight 371.38 g/mol
Molecular Formula C14H13NO7S2
Exact Mass 371.013344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiEOWCQUTF2
Name Methanol, [(4-nitrophenyl)sulfonyl]-, 4-methylbenzenesulfonate
Alternate Name(s) [(4-Nitrophenyl)sulfonyl]methyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid (4-nitrophenyl)sulfonylmethyl ester 4-Methylbenzenesulfonic acid nosylmethyl ester
CAS Registry Number 31081-08-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO7S2
InChI InChI=1S/C14H13NO7S2/c1-11-2-6-14(7-3-11)24(20,21)22-10-23(18,19)13-8-4-12(5-9-13)15(16)17/h2-9H,10H2,1H3
InChIKey NBZIWHFDDGNMEZ-UHFFFAOYSA-N
Molecular Weight 371.378 g/mol
SMILES Cc1ccc(cc1)S(=O)(=O)OCS(c1ccc(cc1)N(=O)=O)(=O)=O
SPLASH splash10-0a4i-2910000000-a13774aad23bbba2dd78
Source of Spectrum O-10-34-1
Wiley ID 1354823