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1-(2-isobutylthiazol-4-yl)-4,4-dimethyl-pentan-1-one
SpectraBase Compound ID 2x9ge8yUze2
InChI InChI=1S/C14H23NOS/c1-10(2)8-13-15-11(9-17-13)12(16)6-7-14(3,4)5/h9-10H,6-8H2,1-5H3
InChIKey XSOPBZFKOBSPEN-UHFFFAOYSA-N
Mol Weight 253.4 g/mol
Molecular Formula C14H23NOS
Exact Mass 253.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DaIpiodlxjV
Name 1-(2-isobutylthiazol-4-yl)-4,4-dimethyl-pentan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H23NOS
InChI InChI=1S/C14H23NOS/c1-10(2)8-13-15-11(9-17-13)12(16)6-7-14(3,4)5/h9-10H,6-8H2,1-5H3
InChIKey XSOPBZFKOBSPEN-UHFFFAOYSA-N
Molecular Weight 253.404 g/mol
SMILES C(CCC(C)(C)C)(=O)c1nc(sc1)CC(C)C
SPLASH splash10-0a4i-9000000000-ea519b11f1a6c1973ec7
Source of Spectrum J-65-4047-57
Synonyms 4,4-dimethyl-1-[2-(2-methylpropyl)-1,3-thiazol-4-yl]pentan-1-one 4,4-dimethyl-1-[2-(2-methylpropyl)-4-thiazolyl]-1-pentanone
Wiley ID 1532464