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Labda-8(17),12E,14-triene-2.alpha.,18-diol
SpectraBase Compound ID AdcH9sDYl1M
InChI InChI=1S/C20H32O2/c1-6-14(2)7-9-17-15(3)8-10-18-19(4,13-21)11-16(22)12-20(17,18)5/h6-7,16-18,21-22H,1,3,8-13H2,2,4-5H3/b14-7+/t16-,17-,18-,19-,20+/m0/s1
InChIKey SWIIQEZMLWUBRB-CWNDDPNYSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 899LsOZI0NF
Name Labda-8(17),12E,14-triene-2.alpha.,18-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-6-14(2)7-9-17-15(3)8-10-18-19(4,13-21)11-16(22)12-20(17,18)5/h6-7,16-18,21-22H,1,3,8-13H2,2,4-5H3/b14-7+/t16-,17-,18-,19-,20+/m0/s1
InChIKey SWIIQEZMLWUBRB-CWNDDPNYSA-N
Molecular Weight 304.474 g/mol
SMILES O[C@@]1(C[C@]2([C@]([C@](CO)(C1)C)(CCC([C@@]2(C\C=C\(C=C)C)[H])=C)[H])C)[H]
SPLASH splash10-0a5a-7900000000-742266f7f3d67d8e7a90
Source of Spectrum G4-70-295-2
Synonyms (2R,4R,4aR,8S,8aR)-4-(hydroxymethyl)-4,8a-dimethyl-7-methylene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalen-2-ol (2R,4R,4aR,8S,8aR)-4-(hydroxymethyl)-4,8a-dimethyl-7-methylene-8-[(2E)-3-methylpenta-2,4-dienyl]decalin-2-ol (2R,4R,4aR,8S,8aR)-4-(hydroxymethyl)-4,8a-dimethyl-7-methylidene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalen-2-ol
Wiley ID 1694876