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

*Links on SpectraBase are not permalinks.
N-Cyano (5-chloro-1,3-dimethyl-1H-pyrazol-4-yl)methylphenyl sulfoximine
SpectraBase Compound ID EmBD3PyLfVr
InChI InChI=1S/C13H13ClN4OS/c1-10-12(13(14)18(2)17-10)8-20(19,16-9-15)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
InChIKey RMNFPOFGCGECGP-UHFFFAOYSA-N
Mol Weight 308.79 g/mol
Molecular Formula C13H13ClN4OS
Exact Mass 308.04986 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 3sxodCK6m6g
Name N-Cyano (5-chloro-1,3-dimethyl-1H-pyrazol-4-yl)methylphenyl sulfoximine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN4OS
InChI InChI=1S/C13H13ClN4OS/c1-10-12(13(14)18(2)17-10)8-20(19,16-9-15)11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
InChIKey RMNFPOFGCGECGP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200900729
Molecular Weight 308.787 g/mol
SMILES c1(S(Cc2c(n[n](c2Cl)C)C)(=NC#N)=O)ccccc1
SPLASH splash10-0006-0900000000-dabae525d6461665e399
Source of Spectrum ASC-352-314-3a
Wiley ID 1764228