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3-isothiocyanato-3-methylbut-1-yne
SpectraBase Compound ID LWBVJL0v1k0
InChI InChI=1S/C6H7NS/c1-4-6(2,3)7-5-8/h1H,2-3H3
InChIKey XHOSLWVYNYNQSM-UHFFFAOYSA-N
Mol Weight 125.19 g/mol
Molecular Formula C6H7NS
Exact Mass 125.02992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GAKWNs2135r
Name 3-isothiocyanato-3-methyl-1-butyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7NS
InChI InChI=1S/C6H7NS/c1-4-6(2,3)7-5-8/h1H,2-3H3
InChIKey XHOSLWVYNYNQSM-UHFFFAOYSA-N
Molecular Weight 125.189 g/mol
SMILES C(N=C=S)(C#C)(C)C
SPLASH splash10-00kf-9100000000-6854e422d5d030de5420
Source of Spectrum K1-2001-1095-3
Synonyms 3-isothiocyanato-3-methylbut-1-yne
Wiley ID 846801