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(3R,4S,5R,7S,9R)-3,9-Dihydroxy-Solavetivone
SpectraBase Compound ID JXRvCIPDKy5
InChI InChI=1S/C15H22O3/c1-8(2)11-6-13(17)15(7-11)9(3)5-12(16)14(18)10(15)4/h5,10-11,13-14,17-18H,1,6-7H2,2-4H3/t10-,11-,13-,14-,15+/m1/s1
InChIKey BLDKDCBSDHBTFV-BBIZWXPBSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWrZvs83LpH
Name (3R,4S,5R,7S,9R)-3,9-Dihydroxy-Solavetivone
Alternate Name(s) (2S,4R,5R,6S,7R)-4,7-dihydroxy-6,10-dimethyl-2-(1-methylethenyl)-8-spiro[4.5]dec-9-enone (2S,4R,5R,6S,7R)-4,7-dihydroxy-6,10-dimethyl-2-prop-1-en-2-ylspiro[4.5]dec-9-en-8-one (2S,4R,5R,6S,7R)-6,10-dimethyl-4,7-bis(oxidanyl)-2-prop-1-en-2-yl-spiro[4.5]dec-9-en-8-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-8(2)11-6-13(17)15(7-11)9(3)5-12(16)14(18)10(15)4/h5,10-11,13-14,17-18H,1,6-7H2,2-4H3/t10-,11-,13-,14-,15+/m1/s1
InChIKey BLDKDCBSDHBTFV-BBIZWXPBSA-N
Molecular Weight 250.338 g/mol
SMILES O[C@]1(C(C=C([C@]2([C@@](C[C@](C2)(C(=C)C)[H])(O)[H])[C@@]1(C)[H])C)=O)[H]
SPLASH splash10-001i-0090000000-8ab2869ee8179e607599
Source of Spectrum G4-61-1518-4
Wiley ID 1607555