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Bicyclo[3.1.0]hexane-3-butanal, 4-oxo-1,6-diphenyl-, (1.alpha.,3.alpha.,5.alpha.,6.beta.)-
SpectraBase Compound ID K75SQ6m9dtA
InChI InChI=1S/C22H22O2/c23-14-8-7-11-17-15-22(18-12-5-2-6-13-18)19(20(22)21(17)24)16-9-3-1-4-10-16/h1-6,9-10,12-14,17,19-20H,7-8,11,15H2/t17-,19+,20+,22-/m0/s1
InChIKey AYFPSVANCPCETD-RYTRXMBJSA-N
Mol Weight 318.42 g/mol
Molecular Formula C22H22O2
Exact Mass 318.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYTi0TjglME
Name Bicyclo[3.1.0]hexane-3-butanal, 4-oxo-1,6-diphenyl-, (1.alpha.,3.alpha.,5.alpha.,6.beta.)-
CAS Registry Number 56434-92-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O2
InChI InChI=1S/C22H22O2/c23-14-8-7-11-17-15-22(18-12-5-2-6-13-18)19(20(22)21(17)24)16-9-3-1-4-10-16/h1-6,9-10,12-14,17,19-20H,7-8,11,15H2/t17-,19+,20+,22-/m0/s1
InChIKey AYFPSVANCPCETD-RYTRXMBJSA-N
Molecular Weight 318.416 g/mol
SMILES [C@@]12([C@](C(=O)[C@](C2)(CCCC=O)[H])([H])[C@]1(c1ccccc1)[H])c1ccccc1
SPLASH splash10-0a4l-6391000000-29350b6829ee6c28ea5e
Source of Spectrum C-97-3738-0
Synonyms trans-5,6-Diphenyl-exo-3-(4-oxobutyl)-bicyclo[3.1.0]hexan-2-one 4-[(1S,3S,5S,6S)-4-oxo-1,6-diphenylbicyclo[3.1.0]hex-3-yl]butanal trans-5.6-diphenyl-endo-3-(4-oxobutyl)-bicyclo(3.1.0)hexan-2-one
Wiley ID 1319047