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1H-3a,7-Methanoazulene-8-pentanol, 2,3,4,7,8,8a-hexahydro-3-(hydroxymethyl)-.beta.,6,8-trimethyl-, [3S-[3.alpha.,3a.alpha.,7.alpha.,8.alpha.(R*),8a.beta.]]-
SpectraBase Compound ID BzRQx7OsG8a
InChI InChI=1S/C20H34O2/c1-14(12-21)5-4-9-19(3)17-11-20(10-8-15(17)2)16(13-22)6-7-18(19)20/h8,14,16-18,21-22H,4-7,9-13H2,1-3H3/t14?,16-,17+,18+,19+,20-/m1/s1
InChIKey OGCVGTVCFCZCRR-HOBSSINXSA-N
Mol Weight 306.5 g/mol
Molecular Formula C20H34O2
Exact Mass 306.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQuZlz2KB0i
Name 1H-3a,7-Methanoazulene-8-pentanol, 2,3,4,7,8,8a-hexahydro-3-(hydroxymethyl)-.beta.,6,8-trimethyl-, [3S-[3.alpha.,3a.alpha.,7.alpha.,8.alpha.(R*),8a.beta.]]-
CAS Registry Number 101467-56-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H34O2
InChI InChI=1S/C20H34O2/c1-14(12-21)5-4-9-19(3)17-11-20(10-8-15(17)2)16(13-22)6-7-18(19)20/h8,14,16-18,21-22H,4-7,9-13H2,1-3H3/t14?,16-,17+,18+,19+,20-/m1/s1
InChIKey OGCVGTVCFCZCRR-HOBSSINXSA-N
Molecular Weight 306.490 g/mol
SMILES OCC(CCC[C@@]1([C@]2([C@@]3([C@@](CO)(CC2)[H])C[C@@]1([H])C(=CC3)C)[H])C)C
SPLASH splash10-0a4i-0921000000-0385a722d844310e524c
Source of Spectrum F-42-221-2
Synonyms 2-Hydroxymethyl-6-(4-methoxymethylpentanyl)-8,6-dimethyl-bicyclo[3,5,1(1,7)]undecene-8 5-[(1S,2S,5S,6S,7S)-2-(hydroxymethyl)-6,8-dimethyltricyclo[5.3.1.0(1,5)]undec-8-en-6-yl]-2-methylpentan-1-ol
Wiley ID 1308575