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

*Links on SpectraBase are not permalinks.
4-Dichloromethyl-3-nitrophenyl toluene-4-sulfonate
SpectraBase Compound ID HD92M0b3j76
InChI InChI=1S/C14H11Cl2NO5S/c1-9-2-5-11(6-3-9)23(20,21)22-10-4-7-12(14(15)16)13(8-10)17(18)19/h2-8,14H,1H3
InChIKey XLNFIAUEDRJOEZ-UHFFFAOYSA-N
Mol Weight 376.21 g/mol
Molecular Formula C14H11Cl2NO5S
Exact Mass 374.973499 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 KwLTgDBD2IM
Name 4-Dichloromethyl-3-nitrophenyl toluene-4-sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11Cl2NO5S
InChI InChI=1S/C14H11Cl2NO5S/c1-9-2-5-11(6-3-9)23(20,21)22-10-4-7-12(14(15)16)13(8-10)17(18)19/h2-8,14H,1H3
InChIKey XLNFIAUEDRJOEZ-UHFFFAOYSA-N
Molecular Weight 376.210 g/mol
SMILES c1(ccc(cc1)S(=O)(=O)Oc1cc(c(cc1)C(Cl)Cl)N(=O)=O)C
SPLASH splash10-052f-9700000000-d8ee9d100badb7893020
Source of Spectrum F-53-4747-10
Synonyms 4-(dichloromethyl)-3-nitrophenyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid [4-(dichloromethyl)-3-nitrophenyl] ester [4-(dichloromethyl)-3-nitrophenyl] 4-methylbenzenesulfonate [4-(dichloromethyl)-3-nitro-phenyl] 4-methylbenzenesulfonate [4-[bis(chloranyl)methyl]-3-nitro-phenyl] 4-methylbenzenesulfonate
Wiley ID 801396