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Bicyclo[3.1.0]hexane-3-propanal, 2-oxo-5,6-diphenyl-, (1.alpha.,3.alpha.,5.alpha.,6.beta.)-
SpectraBase Compound ID 5kROnKSuPpV
InChI InChI=1S/C21H20O2/c22-13-7-10-16-14-21(17-11-5-2-6-12-17)18(19(21)20(16)23)15-8-3-1-4-9-15/h1-6,8-9,11-13,16,18-19H,7,10,14H2/t16-,18+,19+,21-/m1/s1
InChIKey UZWYSASLIJASGG-BOFXEDATSA-N
Mol Weight 304.39 g/mol
Molecular Formula C21H20O2
Exact Mass 304.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3HFXZXOTIc
Name Bicyclo[3.1.0]hexane-3-propanal, 2-oxo-5,6-diphenyl-, (1.alpha.,3.alpha.,5.alpha.,6.beta.)-
CAS Registry Number 56453-60-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O2
InChI InChI=1S/C21H20O2/c22-13-7-10-16-14-21(17-11-5-2-6-12-17)18(19(21)20(16)23)15-8-3-1-4-9-15/h1-6,8-9,11-13,16,18-19H,7,10,14H2/t16-,18+,19+,21-/m1/s1
InChIKey UZWYSASLIJASGG-BOFXEDATSA-N
Molecular Weight 304.389 g/mol
SMILES [C@]12([C@@](C(=O)[C@@](C2)(CCC=O)[H])([H])[C@@]1(c1ccccc1)[H])c1ccccc1
SPLASH splash10-0a4l-4493000000-5caf47a2262142b8a2cf
Source of Spectrum C-97-3733-0
Synonyms trans-5,6-Diphenyl-exo-3-(3-oxopropyl)-bicyclo[3.1.0]hexan-2-one 3-[(1R,3R,5R,6R)-4-oxo-1,6-diphenylbicyclo[3.1.0]hex-3-yl]propanal trans-5,6-diphenyl-endo-3-(3-oxopropyl)bicyclo(3.1.0)-hexan-2-one
Wiley ID 1306988