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

*Links on SpectraBase are not permalinks.
2-Chloro-2-[(4-nitrophenyl)thio]ethanethioic acid S-(4-nitrophenyl) ester
SpectraBase Compound ID Ag4RnV61zMX
InChI InChI=1S/C14H9ClN2O5S2/c15-13(23-11-5-1-9(2-6-11)16(19)20)14(18)24-12-7-3-10(4-8-12)17(21)22/h1-8,13H
InChIKey LQDCMMYROWQVML-UHFFFAOYSA-N
Mol Weight 384.81 g/mol
Molecular Formula C14H9ClN2O5S2
Exact Mass 383.964141 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 ABYXd8yTUwg
Name 2-Chloro-2-[(4-nitrophenyl)thio]ethanethioic acid S-(4-nitrophenyl) ester
CAS Registry Number 63500-20-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9ClN2O5S2
InChI InChI=1S/C14H9ClN2O5S2/c15-13(23-11-5-1-9(2-6-11)16(19)20)14(18)24-12-7-3-10(4-8-12)17(21)22/h1-8,13H
InChIKey LQDCMMYROWQVML-UHFFFAOYSA-N
Molecular Weight 384.808 g/mol
SMILES c1(N(=O)=O)ccc(SC(C(Sc2ccc(N(=O)=O)cc2)=O)Cl)cc1
SPLASH splash10-0aor-4901000000-d034f0602c1ef76c2dc4
Source of Spectrum Y-14-457-0
Synonyms S-(4-nitrophenyl) 2-chloranyl-2-(4-nitrophenyl)sulfanyl-ethanethioate S-(4-nitrophenyl) 2-chloro-2-(4-nitrophenyl)sulfanyl-ethanethioate
Wiley ID 1361280