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2-Chloro-3-isothiocyanatobuta-1,3-diene
SpectraBase Compound ID 9DsjYpL2A5j
InChI InChI=1S/C5H4ClNS/c1-4(6)5(2)7-3-8/h1-2H2
InChIKey NEXCXAIYGFRVMM-UHFFFAOYSA-N
Mol Weight 145.61 g/mol
Molecular Formula C5H4ClNS
Exact Mass 144.975298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mndH0mJTE
Name 2-Chloro-3-isothiocyanatobuta-1,3-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H4ClNS
InChI InChI=1S/C5H4ClNS/c1-4(6)5(2)7-3-8/h1-2H2
InChIKey NEXCXAIYGFRVMM-UHFFFAOYSA-N
Molecular Weight 145.607 g/mol
SMILES C=C(C(=C)N=C=S)Cl
SPLASH splash10-0f6t-9800000000-5d3f3be1bb84ca4fc5d0
Source of Spectrum C5-2002-1431-18
Synonyms 2-Chloranyl-3-isothiocyanato-buta-1,3-diene
Wiley ID 1614807