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4,8-Methanoazulen-6(1H)-one, octahydro-, (3a.alpha.,4.beta.,8.beta.,8a.alpha.)-
SpectraBase Compound ID Cm6WUxqq85x
InChI InChI=1S/C11H16O/c12-9-5-7-4-8(6-9)11-3-1-2-10(7)11/h7-8,10-11H,1-6H2/t7-,8+,10+,11-
InChIKey FTDRFBMDFUCHMY-YDRMRZIKSA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JOl3ar6JdW
Name 4,8-Methanoazulen-6(1H)-one, octahydro-, (3a.alpha.,4.beta.,8.beta.,8a.alpha.)-
CAS Registry Number 53432-46-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c12-9-5-7-4-8(6-9)11-3-1-2-10(7)11/h7-8,10-11H,1-6H2/t7-,8+,10+,11-
InChIKey FTDRFBMDFUCHMY-YDRMRZIKSA-N
Molecular Weight 164.248 g/mol
SMILES [C@]12([C@]3([C@@](CCC3)([H])[C@](C1)([H])CC(C2)=O)[H])[H]
SPLASH splash10-00fr-9600000000-c43dd3e331a1b5abef6f
Source of Spectrum J-40-280-0
Synonyms (1R,2R,6S,7S)-tricyclo[5.3.1.0(2,6)]undecan-9-one 6,7-exo-trimethylenebicyclo[3.2.1]octan-2-one 6,7-exo-trimethylenebicyclo[3.2.1]octan-3-one
Wiley ID 1160818