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6,7-Dihydro-6.alpha.-phenyl-5.beta.,8.beta.-epoxy-5H-benzocyclohepten-9(8H)-one
SpectraBase Compound ID DSJUs5MfYSA
InChI InChI=1S/C17H14O2/c18-16-12-8-4-5-9-13(12)17-14(10-15(16)19-17)11-6-2-1-3-7-11/h1-9,14-15,17H,10H2/t14-,15-,17-/m0/s1
InChIKey QHOVEKVCUZFHLN-ZOBUZTSGSA-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 3k9TGPuMgza
Name 6,7-Dihydro-6.alpha.-phenyl-5.beta.,8.beta.-epoxy-5H-benzocyclohepten-9(8H)-one
Alternate Name(s) (1S,9S,11S)-11-phenyl-12-oxatricyclo[7.2.1.0(2,7)]dodeca-2,4,6-trien-8-one
CAS Registry Number 112295-19-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14O2
InChI InChI=1S/C17H14O2/c18-16-12-8-4-5-9-13(12)17-14(10-15(16)19-17)11-6-2-1-3-7-11/h1-9,14-15,17H,10H2/t14-,15-,17-/m0/s1
InChIKey QHOVEKVCUZFHLN-ZOBUZTSGSA-N
Molecular Weight 250.297 g/mol
SMILES [C@@]12(O[C@@]([H])(C[C@]2(c2ccccc2)[H])C(c2c1cccc2)=O)[H]
SPLASH splash10-0udi-0910000000-715fe8cd2c831bbee849
Source of Spectrum KC-1987-201-31
Wiley ID 1254015