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Isothiocyanic acid o-tolyl ester
SpectraBase Compound ID 8V6ULF43oAw
InChI InChI=1S/C8H7NS/c1-7-4-2-3-5-8(7)9-6-10/h2-5H,1H3
InChIKey JYKYYPPZLPVIBY-UHFFFAOYSA-N
Mol Weight 149.21 g/mol
Molecular Formula C8H7NS
Exact Mass 149.02992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nFAy85VAST
Name 2-Methylphenyl isothiocyanate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NS
InChI InChI=1S/C8H7NS/c1-7-4-2-3-5-8(7)9-6-10/h2-5H,1H3
InChIKey JYKYYPPZLPVIBY-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.6
Molecular Weight 149.211 g/mol
SMILES c1(N=C=S)ccccc1C
SPLASH splash10-00kb-2900000000-9431a374b8d1447ae521
Source of Spectrum BJO-8-SM13-13-1
Wiley ID 1867373