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6,7-Dihydro-7.alpha.-phenyl-5.beta.,8.beta.-epoxy-5H-benzocyclohepten-9(8H)-one
SpectraBase Compound ID 2XAmY0OGEq7
InChI InChI=1S/C17H14O2/c18-16-13-9-5-4-8-12(13)15-10-14(17(16)19-15)11-6-2-1-3-7-11/h1-9,14-15,17H,10H2/t14-,15-,17+/m1/s1
InChIKey LUMNLSKYOYMFAP-INMHGKMJSA-N
Mol Weight 250.3 g/mol
Molecular Formula C17H14O2
Exact Mass 250.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9rBBNsSHqZ7
Name 6,7-Dihydro-7.alpha.-phenyl-5.beta.,8.beta.-epoxy-5H-benzocyclohepten-9(8H)-one
CAS Registry Number 112295-17-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O2
InChI InChI=1S/C17H14O2/c18-16-13-9-5-4-8-12(13)15-10-14(17(16)19-15)11-6-2-1-3-7-11/h1-9,14-15,17H,10H2/t14-,15-,17+/m1/s1
InChIKey LUMNLSKYOYMFAP-INMHGKMJSA-N
Molecular Weight 250.297 g/mol
SMILES [C@]12(O[C@]([H])(C[C@@]2(c2ccccc2)[H])c2c(C1=O)cccc2)[H]
SPLASH splash10-0f89-0910000000-2ddf83035c1b73b7bebd
Source of Spectrum KC-1987-200-29
Synonyms (1R,9R,10R)-10-phenyl-12-oxatricyclo[7.2.1.0(2,7)]dodeca-2,4,6-trien-8-one
Wiley ID 1254014