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(1S,2S,3S,5S,6S,7R)-4.alpha.-D-3-Octyltricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-diol

View entire compound with spectra: 1 MS (GC)

(1S,2S,3S,5S,6S,7R)-4.alpha.-D-3-Octyltricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-diol
SpectraBase Compound ID ATe9bXTNi7G
InChI InChI=1S/C18H30O2/c1-2-3-4-5-6-7-10-18(20)12-15(19)16-13-8-9-14(11-13)17(16)18/h8-9,13-17,19-20H,2-7,10-12H2,1H3/t13-,14+,15-,16+,17+,18-/m0/s1/i12D/t12-,13-,14+,15-,16+,17+,18-
InChIKey YCYIOEQFAUDAKF-VKGSXKPASA-N
Mol Weight 279.44 g/mol
Molecular Formula C18H29DO2
Exact Mass 279.230857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E73bH7nWEaG
Name (1S,2S,3S,5S,6S,7R)-4.alpha.-D-3-Octyltricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29DO2
InChI InChI=1S/C18H30O2/c1-2-3-4-5-6-7-10-18(20)12-15(19)16-13-8-9-14(11-13)17(16)18/h8-9,13-17,19-20H,2-7,10-12H2,1H3/t13-,14+,15-,16+,17+,18-/m0/s1/i12D/t12-,13-,14+,15-,16+,17+,18-
InChIKey YCYIOEQFAUDAKF-VKGSXKPASA-N
Molecular Weight 279.442 g/mol
SMILES O[C@@]1([C@@]2([C@]([C@]([C@]1([D])[H])(O)CCCCCCCC)([C@@]1(C=C[C@]2(C1)[H])[H])[H])[H])[H]
SPLASH splash10-014i-9800000000-754cd650272144d0c4df
Source of Spectrum KC-1993-2158-7
Synonyms (1S,2R,3S,5S,6S,7R)-4.alpha.-D-3-Octyltricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-diol 4.alpha.-D-3-Octyltricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-diol
Wiley ID 779586