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

*Links on SpectraBase are not permalinks.
1-[1-(Allylsulfanyl)-2-nitroethyl]-4-chlorobenzene
SpectraBase Compound ID 6xyJrwutKtQ
InChI InChI=1S/C11H12ClNO2S/c1-2-7-16-11(8-13(14)15)9-3-5-10(12)6-4-9/h2-6,11H,1,7-8H2
InChIKey BXFHTZGQVCCJQF-UHFFFAOYSA-N
Mol Weight 257.73 g/mol
Molecular Formula C11H12ClNO2S
Exact Mass 257.027728 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 14JCfQliZrW
Name 1-[1-(Allylsulfanyl)-2-nitroethyl]-4-chlorobenzene
Alternate Name(s) 1-chloranyl-4-(2-nitro-1-prop-2-enylsulfanyl-ethyl)benzene 1-chloro-4-(2-nitro-1-prop-2-enylsulfanylethyl)benzene 1-chloro-4-[2-nitro-1-(prop-2-enylthio)ethyl]benzene 1-[1-(allylthio)-2-nitro-ethyl]-4-chloro-benzene Benzene, 1-chloro-4-[2-nitro-1-(2-propenylthio)ethyl]-
CAS Registry Number 128869-29-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12ClNO2S
InChI InChI=1S/C11H12ClNO2S/c1-2-7-16-11(8-13(14)15)9-3-5-10(12)6-4-9/h2-6,11H,1,7-8H2
InChIKey BXFHTZGQVCCJQF-UHFFFAOYSA-N
Molecular Weight 257.735 g/mol
SMILES C=CCSC(CN(=O)=O)c1ccc(cc1)Cl
SPLASH splash10-000i-0900000000-c6f1620940cef617271a
Source of Spectrum J-55-5507-7
Wiley ID 1260548