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(2S,3R)-2-ETHYL-2,3-DIHYDRO-6-[(1S,2S)-2-HYDROXY-1-METHYLBUTYL]-3,5-DIMETHYL-4H-PYRAN-4-ONE
SpectraBase Compound ID 3ZDON9cZe94
InChI InChI=1S/C14H24O3/c1-6-11(15)8(3)14-10(5)13(16)9(4)12(7-2)17-14/h8-9,11-12,15H,6-7H2,1-5H3/t8-,9+,11-,12-/m0/s1
InChIKey RYMJYHVKZRJHCX-QCMRWSPLSA-N
Mol Weight 240.34 g/mol
Molecular Formula C14H24O3
Exact Mass 240.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgPEdhL0d2t
Name (2S,3R)-2-ethyl-3,5-dimethyl-6-[(2S,3S)-3-oxidanylpentan-2-yl]-2,3-dihydropyran-4-one
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Formula C14H24O3
InChI InChI=1S/C14H24O3/c1-6-11(15)8(3)14-10(5)13(16)9(4)12(7-2)17-14/h8-9,11-12,15H,6-7H2,1-5H3/t8-,9+,11-,12-/m0/s1
InChIKey RYMJYHVKZRJHCX-QCMRWSPLSA-N
Molecular Weight 240.343 g/mol
SMILES O[C@]([C@@](C1=C(C(=O)[C@@]([C@@](O1)(CC)[H])(C)[H])C)(C)[H])(CC)[H]
SPLASH splash10-0bu0-9600000000-770fefb7888c7a404fbb
Source of Spectrum H-76-1281-1
Synonyms (2S,3R)-2-ethyl-6-[(1S,2S)-2-hydroxy-1-methyl-butyl]-3,5-dimethyl-2,3-dihydropyran-4-one (2S,3R)-2-ethyl-6-[(2S,3S)-3-hydroxypentan-2-yl]-3,5-dimethyl-2,3-dihydropyran-4-one
Wiley ID 1243147