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1,2,4:5,6,8-Dimetheno-s-indacene-4,8a-diol, decahydro-, (1.alpha.,2.alpha.,3a.beta.,4.beta.,4a.alpha.,5.beta.,6.beta.,7a.alp ha.,8.beta.,8a.beta.,9S*,10R*)-(.+-.)-
SpectraBase Compound ID GAj7lzapXjP
InChI InChI=1S/C14H16O2/c15-13-6-2-5-11(13)12(5)14(6,16)10-4-1-3-7(8(3)10)9(4)13/h3-12,15-16H,1-2H2/t3-,4+,5+,6-,7+,8-,9+,10-,11-,12+,13-,14-/m1/s1
InChIKey JHGSOPPPWCJRFC-CXWVMSCMSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZ8cZmd2gmK
Name 1,2,4:5,6,8-Dimetheno-s-indacene-4,8a-diol, decahydro-, (1.alpha.,2.alpha.,3a.beta.,4.beta.,4a.alpha.,5.beta.,6.beta.,7a.alp ha.,8.beta.,8a.beta.,9S*,10R*)-(.+-.)-
Alternate Name(s) Heptacyclo[8.4.0.0(2,12).0(3,8).0(4,6).0(5,9).0(11,13)]tetradecane-2,10-diol Heptacyclo[8.4.0.0(2,7).0(3,5).0(4,8).0(9,13).0(12,14)]tetradecane-1,9-diol
CAS Registry Number 130011-61-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c15-13-6-2-5-11(13)12(5)14(6,16)10-4-1-3-7(8(3)10)9(4)13/h3-12,15-16H,1-2H2/t3-,4+,5+,6-,7+,8-,9+,10-,11-,12+,13-,14-/m1/s1
InChIKey JHGSOPPPWCJRFC-CXWVMSCMSA-N
Molecular Weight 216.280 g/mol
SMILES O[C@@]12[C@]3(C[C@]4([C@]1([C@@]4([C@@]3([C@]1([C@@]3([C@@]2([C@]2([C@@]1([C@@]2(C3)[H])[H])[H])[H])[H])[H])O)[H])[H])[H])[H]
SPLASH splash10-0udl-3900000000-e26050042ee520737714
Source of Spectrum J-55-6106-5
Wiley ID 1215918