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3-Methyl-5-propylisothiazole
SpectraBase Compound ID GIZcWXhjFb8
InChI InChI=1S/C7H11NS/c1-3-4-7-5-6(2)8-9-7/h5H,3-4H2,1-2H3
InChIKey VBXPUFLEBAGKTB-UHFFFAOYSA-N
Mol Weight 141.23 g/mol
Molecular Formula C7H11NS
Exact Mass 141.061221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cwgDX5dnKO
Name 3-Methyl-5-propylisothiazole
Alternate Name(s) 3-Methyl-5-propyl-1,2-thiazole
Comments Less than 3 mono-isotopic peaks
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Formula C7H11NS
InChI InChI=1S/C7H11NS/c1-3-4-7-5-6(2)8-9-7/h5H,3-4H2,1-2H3
InChIKey VBXPUFLEBAGKTB-UHFFFAOYSA-N
Molecular Weight 141.232 g/mol
SMILES Cc1nsc(c1)CCC
SPLASH splash10-03di-0900000000-feeab747ab598867a60b
Source of Spectrum SK-20-622-2b
Wiley ID 1733765