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1,5-Azulenedione, octahydro-7-hydroxy-4,8a-dimethyl-, (3a.alpha.,4.alpha.,7.alpha.,8a.beta.)-(.+-.)-
SpectraBase Compound ID Cyh8ETW5FMO
InChI InChI=1S/C12H18O3/c1-7-9-3-4-11(15)12(9,2)6-8(13)5-10(7)14/h7-9,13H,3-6H2,1-2H3/t7-,8-,9-,12-/m0/s1
InChIKey JAESVIWLTYFHOE-PEFMBERDSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKj1Xod2gWg
Name 1,5-Azulenedione, octahydro-7-hydroxy-4,8a-dimethyl-, (3a.alpha.,4.alpha.,7.alpha.,8a.beta.)-(.+-.)-
Alternate Name(s) (3aS,4S,7R,8aS)-7-hydroxy-4,8a-dimethyloctahydro-1,5-azulenedione 1,6-Dimethyl-9-hydroxybicyclo[5.3.0]decane-2,7-dione
CAS Registry Number 81875-17-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-7-9-3-4-11(15)12(9,2)6-8(13)5-10(7)14/h7-9,13H,3-6H2,1-2H3/t7-,8-,9-,12-/m0/s1
InChIKey JAESVIWLTYFHOE-PEFMBERDSA-N
Molecular Weight 210.273 g/mol
SMILES O[C@]1(CC([C@]([C@]2([C@@](C(CC2)=O)(C1)C)[H])(C)[H])=O)[H]
SPLASH splash10-01ot-9180000000-0dab19b1f0484a5c0c71
Source of Spectrum C-104-7179-0
Wiley ID 1209170