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(3R,3aS,8aR)-3-[(E)-3-hydroxyprop-1-enyl]-2,3,4,5,6,7,8,8a-octahydro-1H-azulen-3a-ol
SpectraBase Compound ID A9d2o6viUOJ
InChI InChI=1S/C13H22O2/c14-10-4-6-12-8-7-11-5-2-1-3-9-13(11,12)15/h4,6,11-12,14-15H,1-3,5,7-10H2/b6-4+/t11-,12+,13+/m1/s1
InChIKey XUODZWPCHGUWFD-IEZGYGFOSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8jXeKDFWkl
Name (3R,3aS,8aR)-3-[(E)-3-hydroxyprop-1-enyl]-2,3,4,5,6,7,8,8a-octahydro-1H-azulen-3a-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c14-10-4-6-12-8-7-11-5-2-1-3-9-13(11,12)15/h4,6,11-12,14-15H,1-3,5,7-10H2/b6-4+/t11-,12+,13+/m1/s1
InChIKey XUODZWPCHGUWFD-IEZGYGFOSA-N
Molecular Weight 210.317 g/mol
SMILES OC\C=C\[C@@]1([C@]2([C@@](CC1)(CCCCC2)[H])O)[H]
SPLASH splash10-03di-0900000000-9188db14c7da1dceba49
Source of Spectrum J-61-5893-2
Synonyms (3R,3aS,8aR)-3-[(E)-3-oxidanylprop-1-enyl]-2,3,4,5,6,7,8,8a-octahydro-1H-azulen-3a-ol
Wiley ID 1209691