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3-isothiocyanatoprop-1-yne
SpectraBase Compound ID 3l3217JxPKZ
InChI InChI=1S/C4H3NS/c1-2-3-5-4-6/h1H,3H2
InChIKey XCXOHPXTLZMKQJ-UHFFFAOYSA-N
Mol Weight 97.13 g/mol
Molecular Formula C4H3NS
Exact Mass 96.99862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XK9xU1FxuK
Name 2-Propynyl thiocyanate
CAS Registry Number 24309-48-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H3NS
InChI InChI=1S/C4H3NS/c1-2-3-5-4-6/h1H,3H2
InChIKey XCXOHPXTLZMKQJ-UHFFFAOYSA-N
Molecular Weight 97.135 g/mol
SMILES C(N=C=S)C#C
SPLASH splash10-000i-9000000000-207f2237a54f17c8088b
Source of Spectrum K1-2001-1095-3
Synonyms 3-Isothiocyanato-1-propyne Thiocyanic acid, 2-propynyl ester
Wiley ID 846802