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4-METHYLPHENYLTHIOCYANAT
SpectraBase Compound ID 2PaZdBXuTTE
InChI InChI=1S/C8H7NS/c1-7-2-4-8(5-3-7)10-6-9/h2-5H,1H3
InChIKey VDURJIGQVKMELT-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 79RucGaeJew
Name (4-methylphenyl) thiocyanate
Alternate Name(s) Thiocyanic acid (4-methylphenyl) ester 1-Methyl-4-thiocyanatobenzene Thiocyanic acid p-tolyl ester p-Tolyl thiocyanate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7NS
InChI InChI=1S/C8H7NS/c1-7-2-4-8(5-3-7)10-6-9/h2-5H,1H3
InChIKey VDURJIGQVKMELT-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ob01655f
Molecular Weight 149.211 g/mol
SMILES c1cc(SC#N)ccc1C
SPLASH splash10-00ke-6900000000-e3e70cd3fd9a60291248
Source of Spectrum F5-12-9200/SM-3h
Wiley ID 1755938