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(3S*,3aR*,4S*,7S*,7aS*)-3-Benzyl-7-hydroxyoctahydro-1H-inden-4-yl acetate
SpectraBase Compound ID 1dVt5TJsVID
InChI InChI=1S/C18H24O3/c1-12(19)21-17-10-9-16(20)15-8-7-14(18(15)17)11-13-5-3-2-4-6-13/h2-6,14-18,20H,7-11H2,1H3/t14-,15+,16-,17-,18+/m0/s1
InChIKey SWTBBMUWMJLLOJ-FLXSYLCISA-N
Mol Weight 288.39 g/mol
Molecular Formula C18H24O3
Exact Mass 288.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ci8o6nr4WaD
Name (3S*,3aR*,4S*,7S*,7aS*)-3-Benzyl-7-hydroxyoctahydro-1H-inden-4-yl acetate
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Formula C18H24O3
InChI InChI=1S/C18H24O3/c1-12(19)21-17-10-9-16(20)15-8-7-14(18(15)17)11-13-5-3-2-4-6-13/h2-6,14-18,20H,7-11H2,1H3/t14-,15+,16-,17-,18+/m0/s1
InChIKey SWTBBMUWMJLLOJ-FLXSYLCISA-N
Ionization Type EI
Literature Reference DOI 10.1021/ml300283f
Molecular Weight 288.387 g/mol
Reported Formula C18H24O3
SMILES O[C@]1(CC[C@@]([C@]2([C@@]1(CC[C@]2(Cc1ccccc1)[H])[H])[H])(OC(C)=O)[H])[H]
SPLASH splash10-004l-7590000000-99297dc9af35c3d2a2d6
Source of Spectrum MCS-3-SM4-6d
Wiley ID 1864118