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1-Butene, 4-isothiocyanato-
SpectraBase Compound ID Kgf0j9z0iGB
InChI InChI=1S/C5H7NS/c1-2-3-4-6-5-7/h2H,1,3-4H2
InChIKey SKIHGKNFJKJXPX-UHFFFAOYSA-N
Mol Weight 113.18 g/mol
Molecular Formula C5H7NS
Exact Mass 113.02992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HoJkqTvuGv
Name 1-Butene, 4-isothiocyanato-
CAS Registry Number 3386-97-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H7NS
InChI InChI=1S/C5H7NS/c1-2-3-4-6-5-7/h2H,1,3-4H2
InChIKey SKIHGKNFJKJXPX-UHFFFAOYSA-N
Molecular Weight 113.178 g/mol
SMILES C(N=C=S)CC=C
SPLASH splash10-00di-9100000000-3e15d27180c2ee16363f
Source of Spectrum AA-0-391-3
Synonyms 4-Isothiocyanato-1-butene 3-Butenyl isothiocyanate 4-isothiocyanatobut-1-ene Isothiocyanic acid, 3-butenyl ester EINECS 222-209-8
Wiley ID 3026