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6.alpha.-acetyl-4.beta.,5.beta.-dimethyl-1(10).alpha.-epoxy-2.beta.,7.beta.-dihydroxydecalin
SpectraBase Compound ID 2n5Wp8KwLlq
InChI InChI=1S/C14H22O4/c1-7-6-10(17)12-14(18-12)5-4-9(16)11(8(2)15)13(7,14)3/h7,9-12,16-17H,4-6H2,1-3H3/t7-,9+,10+,11-,12-,13-,14-/m0/s1
InChIKey QBZBEMFNBTTWIR-ZXEVPWHLSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4AC9ycffBm
Name 6.alpha.-acetyl-4.beta.,5.beta.-dimethyl-1(10).alpha.-epoxy-2.beta.,7.beta.-dihydroxydecalin
Alternate Name(s) Laevinol G
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Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-7-6-10(17)12-14(18-12)5-4-9(16)11(8(2)15)13(7,14)3/h7,9-12,16-17H,4-6H2,1-3H3/t7-,9+,10+,11-,12-,13-,14-/m0/s1
InChIKey QBZBEMFNBTTWIR-ZXEVPWHLSA-N
Instrument Name JEOL JMS-SX/SX 102A
Ionization Type EI
Literature Reference DOI 10.1021/np050326r
Molecular Weight 254.326 g/mol
Optical Rotation [a]D25 = -166 (c = 0.3, CHCl3)
Reported Formula C14H22O4
SMILES O[C@]1([C@@]([C@]2([C@@]3([C@]([C@@](C[C@@]2(C)[H])(O)[H])(O3)[H])CC1)C)(C(=O)C)[H])[H]
SPLASH splash10-0a4i-0910000000-e83c4e6b1e391998a00b
Source of Spectrum G4-68-1751-7
Wiley ID 1879498