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(1.alpha.,4.alpha.,4a.alpha.,11b.beta.)-1,4,4a,6,7,11b-Hexahydro-1,4-epoxy-5H-dibenzo[a,c]cyclohepten-5-one
SpectraBase Compound ID L7fgCLsTTeu
InChI InChI=1S/C15H14O2/c16-11-6-5-9-3-1-2-4-10(9)14-12-7-8-13(17-12)15(11)14/h1-4,7-8,12-15H,5-6H2/t12-,13+,14-,15-/m1/s1
InChIKey VGPHANADLSVJIN-LXTVHRRPSA-N
Mol Weight 226.27 g/mol
Molecular Formula C15H14O2
Exact Mass 226.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Dg4wsHwQVV
Name (1.alpha.,4.alpha.,4a.alpha.,11b.beta.)-1,4,4a,6,7,11b-Hexahydro-1,4-epoxy-5H-dibenzo[a,c]cyclohepten-5-one
CAS Registry Number 71975-02-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O2
InChI InChI=1S/C15H14O2/c16-11-6-5-9-3-1-2-4-10(9)14-12-7-8-13(17-12)15(11)14/h1-4,7-8,12-15H,5-6H2/t12-,13+,14-,15-/m1/s1
InChIKey VGPHANADLSVJIN-LXTVHRRPSA-N
Molecular Weight 226.275 g/mol
SMILES [C@@]12([C@@]3(O[C@]([C@]2(C(CCc2c1cccc2)=O)[H])(C=C3)[H])[H])[H]
SPLASH splash10-053r-4900000000-f3bb03fd5f7bbc1f2110
Source of Spectrum J-44-4755-0
Synonyms (1R,2R,12S,13S)-16-oxatetracyclo[11.2.1.0(2,12).0(3,8)]hexadeca-3,5,7,14-tetraen-11-one
Wiley ID 1228011