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

*Links on SpectraBase are not permalinks.

Phenylisothiocyanate

View entire compound with spectra: 26 NMR, 9 FTIR, 1 Raman, 13 MS (GC), and 2 Near IR

Phenylisothiocyanate
SpectraBase Compound ID G3PhJzMRLGe
InChI InChI=1S/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5H
InChIKey QKFJKGMPGYROCL-UHFFFAOYSA-N
Mol Weight 135.18 g/mol
Molecular Formula C7H5NS
Exact Mass 135.01427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Aq9jPaOHQwx
Name PHENYLISOTHIOCYANAT
CAS Registry Number 103-72-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H5NS
InChI InChI=1S/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5H
InChIKey QKFJKGMPGYROCL-UHFFFAOYSA-N
Literature Reference Author R.G.JONES,G.ALLEN
Literature Reference Citation ORG.MAGN.RES.,19,196(1982)
Literature Reference DOI 10.1002/mrc.1270190408
Molecular Weight 135.183 g/mol
Solvent CDCl3
Source File Reference UNIW2686