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2-Chlorophenyl isothiocyanate
SpectraBase Compound ID KcUj7L9MgWU
InChI InChI=1S/C7H4ClNS/c8-6-3-1-2-4-7(6)9-5-10/h1-4H
InChIKey DASSPOJBUMBXLU-UHFFFAOYSA-N
Mol Weight 169.63 g/mol
Molecular Formula C7H4ClNS
Exact Mass 168.975298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6mpqRhFkQR
Name 2-Chlorophenyl isothiocyanate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4ClNS
InChI InChI=1S/C7H4ClNS/c8-6-3-1-2-4-7(6)9-5-10/h1-4H
InChIKey DASSPOJBUMBXLU-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.6
Molecular Weight 169.629 g/mol
SMILES c1(N=C=S)ccccc1Cl
SPLASH splash10-014i-1900000000-fda1da17e124ee43a050
Source of Spectrum BJO-8-SM17-17-1
Wiley ID 1867377