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(2R*,3S*,6R*,9R*,10S*,13S*,14S*)-Prevezol B

View entire compound with spectra: 1 MS (GC)

(2R*,3S*,6R*,9R*,10S*,13S*,14S*)-Prevezol B
SpectraBase Compound ID 8bvsIPBIIuG
InChI InChI=1S/C20H33BrO3/c1-12(2)15-7-9-20(5,24)18(22)16(15)10-13(3)14-6-8-19(4,23)17(21)11-14/h14-18,22-24H,1,3,6-11H2,2,4-5H3/t14-,15-,16-,17-,18+,19+,20+/m1/s1
InChIKey MKFNGLHIEAHRCD-PHJNVHRLSA-N
Mol Weight 401.4 g/mol
Molecular Formula C20H33BrO3
Exact Mass 400.161308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJGlFO6rmxA
Name (2R*,3S*,6R*,9R*,10S*,13S*,14S*)-Prevezol B
Alternate Name(s) (1S,2S,3R,4S)-3-[2-[(1R,3R,4S)-3-bromo-4-hydroxy-4-methylcyclohexyl]prop-2-enyl]-1-methyl-4-(1-methylethenyl)cyclohexane-1,2-diol (1S,2S,3R,4S)-3-[2-[(1R,3R,4S)-3-bromo-4-hydroxy-4-methylcyclohexyl]prop-2-enyl]-1-methyl-4-prop-1-en-2-ylcyclohexane-1,2-diol (1S,2S,3R,4S)-3-[2-[(1R,3R,4S)-3-bromanyl-4-methyl-4-oxidanyl-cyclohexyl]prop-2-enyl]-1-methyl-4-prop-1-en-2-yl-cyclohexane-1,2-diol
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Formula C20H33BrO3
InChI InChI=1S/C20H33BrO3/c1-12(2)15-7-9-20(5,24)18(22)16(15)10-13(3)14-6-8-19(4,23)17(21)11-14/h14-18,22-24H,1,3,6-11H2,2,4-5H3/t14-,15-,16-,17-,18+,19+,20+/m1/s1
InChIKey MKFNGLHIEAHRCD-PHJNVHRLSA-N
Molecular Weight 401.385 g/mol
SMILES O[C@@]1([C@](CC[C@@]([C@]1(CC([C@@]1(CC[C@@]([C@@](C1)(Br)[H])(O)C)[H])=C)[H])(C(=C)C)[H])(O)C)[H]
SPLASH splash10-006x-6900000000-5d55cd59b8ff6ba6205b
Source of Spectrum F-68-7673-2
Wiley ID 1573455