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1,2(cis),2,3(trans),3,4(cis),-1,2-bis(p-acetylphenyl)-3,4-diphenylcyclobutane)
SpectraBase Compound ID DQzQEB4oBfK
InChI InChI=1S/C32H28O2/c1-21(33)23-13-17-27(18-14-23)31-29(25-9-5-3-6-10-25)30(26-11-7-4-8-12-26)32(31)28-19-15-24(16-20-28)22(2)34/h3-20,29-32H,1-2H3/t29-,30+,31+,32-
InChIKey MEJPXJNMECQEFL-UTRLAFKGSA-N
Mol Weight 444.6 g/mol
Molecular Formula C32H28O2
Exact Mass 444.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbZN7HhLSbZ
Name 1,2(cis),2,3(trans),3,4(cis),-1,2-bis(p-acetylphenyl)-3,4-diphenylcyclobutane)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28O2
InChI InChI=1S/C32H28O2/c1-21(33)23-13-17-27(18-14-23)31-29(25-9-5-3-6-10-25)30(26-11-7-4-8-12-26)32(31)28-19-15-24(16-20-28)22(2)34/h3-20,29-32H,1-2H3/t29-,30+,31+,32-
InChIKey MEJPXJNMECQEFL-UTRLAFKGSA-N
Molecular Weight 444.574 g/mol
SMILES [C@@]1([C@](c2ccc(cc2)C(=O)C)([C@]([C@]1(c1ccccc1)[H])(c1ccccc1)[H])[H])(c1ccc(cc1)C(=O)C)[H]
SPLASH splash10-00di-0090000000-47106c665b135e3d04a6
Source of Spectrum J-54-591-4
Synonyms 1-{4-[(1R,2S,3R,4S)-2-(4-acetylphenyl)-3,4-diphenylcyclobutyl]phenyl}ethanone
Wiley ID 1386268