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labdane-8.alpha.,14-diol
SpectraBase Compound ID UMtKoQ7cmC
InChI InChI=1S/C20H38O2/c1-14(15(2)21)8-9-17-19(5)12-7-11-18(3,4)16(19)10-13-20(17,6)22/h14-17,21-22H,7-13H2,1-6H3/t14-,15?,16-,17+,19-,20+/m0/s1
InChIKey QUDSUGNMIACURK-NXZZIVAGSA-N
Mol Weight 310.5 g/mol
Molecular Formula C20H38O2
Exact Mass 310.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JVnMaTbnwbk
Name labdane-8.alpha.,14-diol
Alternate Name(s) (1R,2R,4aS,8aS)-1-[(3S)-4-hydroxy-3-methylpentyl]-2,5,5,8a-tetramethyldecahydro-2-naphthalenol
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Formula C20H38O2
InChI InChI=1S/C20H38O2/c1-14(15(2)21)8-9-17-19(5)12-7-11-18(3,4)16(19)10-13-20(17,6)22/h14-17,21-22H,7-13H2,1-6H3/t14-,15?,16-,17+,19-,20+/m0/s1
InChIKey QUDSUGNMIACURK-NXZZIVAGSA-N
Molecular Weight 310.522 g/mol
SMILES OC([C@](CC[C@]1([C@@](CC[C@@]2([C@@]1(CCCC2(C)C)C)[H])(O)C)[H])(C)[H])C
SPLASH splash10-0096-0090000000-43c5187065e1c1a05175
Source of Spectrum B-44-472-9
Wiley ID 1312001