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1H-3a,7-Methanoazulene-8-methanol, 2,3,6,7,8,8a-hexahydro-6-hydroxy-3,8-dimethyl-, (3.alpha.,3a.beta.,6.alpha.,7.beta.,8.alpha.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID B1yvDn6ahlQ
InChI InChI=1S/C14H22O2/c1-9-3-4-12-13(2,8-15)10-7-14(9,12)6-5-11(10)16/h5-6,9-12,15-16H,3-4,7-8H2,1-2H3/t9-,10+,11-,12+,13-,14+/m1/s1
InChIKey LHOUVOIIWMPKDX-WZBKEBKWSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTKMF1QSfYm
Name 1H-3a,7-Methanoazulene-8-methanol, 2,3,6,7,8,8a-hexahydro-6-hydroxy-3,8-dimethyl-, (3.alpha.,3a.beta.,6.alpha.,7.beta.,8.alpha.,8a.alpha.)-(.+-.)-
CAS Registry Number 88555-75-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-9-3-4-12-13(2,8-15)10-7-14(9,12)6-5-11(10)16/h5-6,9-12,15-16H,3-4,7-8H2,1-2H3/t9-,10+,11-,12+,13-,14+/m1/s1
InChIKey LHOUVOIIWMPKDX-WZBKEBKWSA-N
Molecular Weight 222.328 g/mol
SMILES OC[C@]1([C@]2([C@@]3(C[C@]1([C@](C=C3)(O)[H])[H])[C@@](CC2)(C)[H])[H])C
SPLASH splash10-0002-0900000000-7619de8e7a0913c22b86
Source of Spectrum F-39-2767-0
Synonyms (1S,2R,5R,6S,7R,8S)-6-(hydroxymethyl)-2,6-dimethyltricyclo[5.3.1.0(1,5)]undec-9-en-8-ol 1SR,2RS,5RS,6SR,7RS,8SR-2,6-dimethyl-8-hydroxy-6-hydroxymethyltricyclo[5.3.1]undec-9-ene
Wiley ID 1222872