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3-(p-Methylphenyl)hexahydrothiazolo[3,2-a]pyridin-5-one
SpectraBase Compound ID DV8H8kyvkOK
InChI InChI=1S/C14H17NOS/c1-10-2-4-11(5-3-10)12-8-13(16)15-6-7-17-14(15)9-12/h2-5,12,14H,6-9H2,1H3/t12-,14-/m1/s1
InChIKey NLSLYDBHFVSNOO-TZMCWYRMSA-N
Mol Weight 247.36 g/mol
Molecular Formula C14H17NOS
Exact Mass 247.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeuUMDkhCnK
Name 3-(p-Methylphenyl)hexahydrothiazolo[3,2-a]pyridin-5-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H17NOS
InChI InChI=1S/C14H17NOS/c1-10-2-4-11(5-3-10)12-8-13(16)15-6-7-17-14(15)9-12/h2-5,12,14H,6-9H2,1H3/t12-,14-/m1/s1
InChIKey NLSLYDBHFVSNOO-TZMCWYRMSA-N
Molecular Weight 247.356 g/mol
SMILES C1(N2[C@@](C[C@@](C1)(c1ccc(cc1)C)[H])(SCC2)[H])=O
SPLASH splash10-0a4i-0930000000-b40c3a7ccd24e5be20a3
Source of Spectrum SO-0-138-6
Synonyms (7R,8aR)-7-p-Tolyl-hexahydro-thiazolo[3,2-a]pyridin-5-one 3-(4-methylphenyl)hexahydro-5H-[1,3]thiazolo[3,2-a]pyridin-5-one 7-(p-Methylphenyl)hexahydrothiazolo[3,2-a]pyridin-5-one (7R,8aR)-7-(4-methylphenyl)-2,3,6,7,8,8a-hexahydrothiazolo[3,2-a]pyridin-5-one (7R,8aR)-7-(4-methylphenyl)-2,3,6,7,8,8a-hexahydro-[1,3]thiazolo[3,2-a]pyridin-5-one
Wiley ID 864030