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4-methylpent-4-en-2-ynylimino-thioxo-methane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-methylpent-4-en-2-ynylimino-thioxo-methane
SpectraBase Compound ID FObxE6FA1GP
InChI InChI=1S/C7H7NS/c1-7(2)4-3-5-8-6-9/h1,5H2,2H3
InChIKey PFFALICQUXWYRR-UHFFFAOYSA-N
Mol Weight 137.2 g/mol
Molecular Formula C7H7NS
Exact Mass 137.02992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 48mvxGBAsy
Name 5-(Isothiocyanato)-2-methylpent-1-en-3-yne
Alternate Name(s) 5-isothiocyanato-2-methyl-1-penten-3-yne 5-isothiocyanato-2-methylpent-1-en-3-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NS
InChI InChI=1S/C7H7NS/c1-7(2)4-3-5-8-6-9/h1,5H2,2H3
InChIKey PFFALICQUXWYRR-UHFFFAOYSA-N
Molecular Weight 137.200 g/mol
SMILES C(N=C=S)C#CC(=C)C
SPLASH splash10-004i-9200000000-28e2d1f5df2a1d9558fc
Source of Spectrum K1-2001-1095-3
Wiley ID 846800