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7-.alpha.-Acetoxy-(1H.alpha.,6H.alpha.)-bicyclo[4.4.1]undeca-2,4,8-trien-11-ol
SpectraBase Compound ID 5cspsIHwsLE
InChI InChI=1S/C13H16O3/c1-9(14)16-12-8-4-6-10-5-2-3-7-11(12)13(10)15/h2-5,7-8,10-13,15H,6H2,1H3/t10-,11+,12+,13?/m0/s1
InChIKey KYGYMSIOSRIYAE-VCKSIFHUSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1viQXBuh0UG
Name 7-.alpha.-Acetoxy-(1H.alpha.,6H.alpha.)-bicyclo[4.4.1]undeca-2,4,8-trien-11-ol
Alternate Name(s) (1S,2S,6S)-11-hydroxybicyclo[4.4.1]undeca-3,7,9-trien-2-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-9(14)16-12-8-4-6-10-5-2-3-7-11(12)13(10)15/h2-5,7-8,10-13,15H,6H2,1H3/t10-,11+,12+,13?/m0/s1
InChIKey KYGYMSIOSRIYAE-VCKSIFHUSA-N
Molecular Weight 220.268 g/mol
SMILES OC1[C@]2([C@](OC(=O)C)(C=CC[C@@]1(C=CC=C2)[H])[H])[H]
SPLASH splash10-01ox-6900000000-ed533792601f497f4b22
Source of Spectrum J-58-6289-0
Wiley ID 1219957