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(4S)-4,5-Dihydro-2-(2',4'-dihydroxyphenyl)-4-(2-methylpropyl)oxazole
SpectraBase Compound ID KNi7ap27dbd
InChI InChI=1S/C13H17NO3/c1-8(2)5-9-7-17-13(14-9)11-4-3-10(15)6-12(11)16/h3-4,6,8-9,15-16H,5,7H2,1-2H3/t9-/m0/s1
InChIKey XBUOSJJOHQEFCY-VIFPVBQESA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Gb40jidM0T
Name (4S)-4,5-Dihydro-2-(2',4'-dihydroxyphenyl)-4-(2-methylpropyl)oxazole
Alternate Name(s) 4-[(4S)-4-isobutyl-4,5-dihydro-1,3-oxazol-2-yl]-1,3-benzenediol
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Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-8(2)5-9-7-17-13(14-9)11-4-3-10(15)6-12(11)16/h3-4,6,8-9,15-16H,5,7H2,1-2H3/t9-/m0/s1
InChIKey XBUOSJJOHQEFCY-VIFPVBQESA-N
Molecular Weight 235.283 g/mol
SMILES Oc1ccc(c(c1)O)C1=N[C@@](CC(C)C)(CO1)[H]
SPLASH splash10-004i-0910000000-7b68e66a60ff610ee5d8
Source of Spectrum C-117-8319-4
Wiley ID 759000