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(4R,6S)-3-methyl-6-[(2S)-6-methyl-2-oxidanyl-hept-5-en-2-yl]-4-oxidanyl-cyclohex-2-en-1-one
SpectraBase Compound ID AY29geYHo71
InChI InChI=1S/C15H24O3/c1-10(2)6-5-7-15(4,18)12-9-13(16)11(3)8-14(12)17/h6,8,12-13,16,18H,5,7,9H2,1-4H3/t12-,13-,15+/m1/s1
InChIKey ABUUSHLXFTWWDH-NFAWXSAZSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G6XdRGPSKQo
Name (4R,6S)-3-methyl-6-[(2S)-6-methyl-2-oxidanyl-hept-5-en-2-yl]-4-oxidanyl-cyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-10(2)6-5-7-15(4,18)12-9-13(16)11(3)8-14(12)17/h6,8,12-13,16,18H,5,7,9H2,1-4H3/t12-,13-,15+/m1/s1
InChIKey ABUUSHLXFTWWDH-NFAWXSAZSA-N
Molecular Weight 252.354 g/mol
SMILES O[C@]1(C(=CC([C@]([C@@](O)(CCC=C(C)C)C)(C1)[H])=O)C)[H]
SPLASH splash10-0aor-5910000000-fdbf1072a50395483f15
Source of Spectrum X2-55-1140-2
Synonyms (4R,6S)-4-hydroxy-6-[(1S)-1-hydroxy-1,5-dimethyl-hex-4-enyl]-3-methyl-cyclohex-2-en-1-one (4R,6S)-4-hydroxy-6-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-3-methyl-1-cyclohex-2-enone (4R,6S)-4-hydroxy-6-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-3-methylcyclohex-2-en-1-one
Wiley ID 1604545