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1H-Cyclopentacyclooctene-5-methanol, 2,3,3a,4,5,9a-hexahydro-9a-hydroxy-3,5-dimethyl-, (3.alpha.,3a.alpha.,5.beta.,9a.beta.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

1H-Cyclopentacyclooctene-5-methanol, 2,3,3a,4,5,9a-hexahydro-9a-hydroxy-3,5-dimethyl-, (3.alpha.,3a.alpha.,5.beta.,9a.beta.)-(.+-.)-
SpectraBase Compound ID 2IbXtszfSrf
InChI InChI=1S/C14H22O2/c1-11-5-6-12-9-13(2,10-15)7-3-4-8-14(11,12)16/h3-4,7-8,11-12,15-16H,5-6,9-10H2,1-2H3/b7-3-,8-4-/t11-,12+,13+,14+/m0/s1
InChIKey DRAYCJYKDHVHNV-MHBMRSJLSA-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 H7EynZqaaiA
Name 1H-Cyclopentacyclooctene-5-methanol, 2,3,3a,4,5,9a-hexahydro-9a-hydroxy-3,5-dimethyl-, (3.alpha.,3a.alpha.,5.beta.,9a.beta.)-(.+-.)-
CAS Registry Number 129918-52-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-11-5-6-12-9-13(2,10-15)7-3-4-8-14(11,12)16/h3-4,7-8,11-12,15-16H,5-6,9-10H2,1-2H3/b7-3-,8-4-/t11-,12+,13+,14+/m0/s1
InChIKey DRAYCJYKDHVHNV-MHBMRSJLSA-N
Molecular Weight 222.328 g/mol
SMILES OC[C@]1(C[C@@]2([C@@](\C=C/C=C\1)([C@](CC2)(C)[H])O)[H])C
SPLASH splash10-0pb9-0090000000-9ce96e9d0873f315e9af
Source of Spectrum C-112-8495-19
Synonyms (3S,3aR,8S,9aR)-8-(hydroxymethyl)-3,8-dimethyl-1,2,3,8,9,9a-hexahydro-3aH-cyclopenta[a]cycloocten-3a-ol 3,8-Dimethyl-8-hydroxymethyl-3a-hydroxy-cyclopentacycloocta-4,7-diene
Wiley ID 1222948