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ent-17-Hydroxytrachylobane
SpectraBase Compound ID 1mTFyfYvqme
InChI InChI=1S/C20H32O/c1-17(2)6-4-7-18(3)15(17)5-8-19-10-14-13(9-16(18)19)20(14,11-19)12-21/h13-16,21H,4-12H2,1-3H3/t13-,14+,15-,16+,18-,19-,20+/m1/s1
InChIKey GNBQIHXGKWONGA-MZGDTODISA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1atWOf4Ov0B
Name ent-17-Hydroxytrachylobane
Appearance White gum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O
InChI InChI=1S/C20H32O/c1-17(2)6-4-7-18(3)15(17)5-8-19-10-14-13(9-16(18)19)20(14,11-19)12-21/h13-16,21H,4-12H2,1-3H3/t13-,14+,15-,16+,18-,19-,20+/m1/s1
InChIKey GNBQIHXGKWONGA-MZGDTODISA-N
Instrument Name Hewlett-Packard G1800A
Ionization Type EI
Literature Reference DOI 10.1021/np900806j
Molecular Weight 288.475 g/mol
Optical Rotation [a]D20 = -29.2 (c = 0.11, CHCl3)
Reported Formula C20H32O
SMILES OC[C@]12[C@@]3(C[C@]4([C@@]5(CCCC([C@]5(CC[C@]4(C1)C[C@]23[H])[H])(C)C)C)[H])[H]
SPLASH splash10-0aou-9420000000-2f40c15aa4824db14540
Source of Spectrum G4-73-663-10
Wiley ID 1872283