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3a,8a-cis-8,8a-trans-8-Phenyl-3,3a,8,8a-tetrahydrocyclopent[a]-inden-1(2H)-one
SpectraBase Compound ID HeX5wiaHFkj
InChI InChI=1S/C18H16O/c19-16-11-10-15-13-8-4-5-9-14(13)17(18(15)16)12-6-2-1-3-7-12/h1-9,15,17-18H,10-11H2/t15-,17-,18+/m1/s1
InChIKey OSUGXDWCIXQIBV-NXHRZFHOSA-N
Mol Weight 248.32 g/mol
Molecular Formula C18H16O
Exact Mass 248.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8eHbXUz8U6
Name 3a,8a-cis-8,8a-trans-8-Phenyl-3,3a,8,8a-tetrahydrocyclopent[a]-inden-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O
InChI InChI=1S/C18H16O/c19-16-11-10-15-13-8-4-5-9-14(13)17(18(15)16)12-6-2-1-3-7-12/h1-9,15,17-18H,10-11H2/t15-,17-,18+/m1/s1
InChIKey OSUGXDWCIXQIBV-NXHRZFHOSA-N
Molecular Weight 248.325 g/mol
SMILES [C@@]12([C@@](c3ccccc3[C@]2(c2ccccc2)[H])(CCC1=O)[H])[H]
SPLASH splash10-0006-0930000000-3d5ce09a108706de3dce
Source of Spectrum AJ-61-2903-11
Synonyms (3aS,8R,8aR)-8-phenyl-3,3a,8,8a-tetrahydrocyclopenta[a]inden-1(2H)-one
Wiley ID 1251818