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Cyclopent[a]inden-8(2H)-one, 3,3a,3b,4,5,6,7,7a-octahydro-, (3a.alpha.,3.beta.,7a.alpha.)-
SpectraBase Compound ID 9M74ubhCaN9
InChI InChI=1S/C12H16O/c13-12-10-5-2-1-4-8(10)9-6-3-7-11(9)12/h7-10H,1-6H2/t8-,9-,10+/m1/s1
InChIKey WAVARCYTNHIUQK-BBBLOLIVSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ASQYP9u92sN
Name Cyclopent[a]inden-8(2H)-one, 3,3a,3b,4,5,6,7,7a-octahydro-, (3a.alpha.,3.beta.,7a.alpha.)-
CAS Registry Number 118451-79-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c13-12-10-5-2-1-4-8(10)9-6-3-7-11(9)12/h7-10H,1-6H2/t8-,9-,10+/m1/s1
InChIKey WAVARCYTNHIUQK-BBBLOLIVSA-N
Molecular Weight 176.259 g/mol
SMILES C=12C([C@]3(CCCC[C@@]3([C@]2(CCC1)[H])[H])[H])=O
SPLASH splash10-0006-9200000000-cfd35a1ace8801bcbc3d
Source of Spectrum F-44-4058-0
Synonyms (3a.alpha.,3b..beta.,7a.alpha.)-3,3a,3b,4,,5,6,7,7a-octahydro-2H-cyclopent[a]inden-8-one (3aR,3bR,7aS)-3,3a,3b,4,5,6,7,7a-octahydrocyclopenta[a]inden-8(2H)-one
Wiley ID 1172738