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1,4-{1'-[2"-(4"'-Chlorobenzoyl)-3"-phenylcyclopropylcarbonyl]benzene
SpectraBase Compound ID L85QQ88BR4M
InChI InChI=1S/C40H28Cl2O4/c41-29-19-15-27(16-20-29)39(45)35-31(23-7-3-1-4-8-23)33(35)37(43)25-11-13-26(14-12-25)38(44)34-32(24-9-5-2-6-10-24)36(34)40(46)28-17-21-30(42)22-18-28/h1-22,31-36H
InChIKey ROFIBCKPBIVVTF-UHFFFAOYSA-N
Mol Weight 643.6 g/mol
Molecular Formula C40H28Cl2O4
Exact Mass 642.136465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoVVFrFE6CF
Name 1,4-{1'-[2"-(4"'-Chlorobenzoyl)-3"-phenylcyclopropylcarbonyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H28Cl2O4
InChI InChI=1S/C40H28Cl2O4/c41-29-19-15-27(16-20-29)39(45)35-31(23-7-3-1-4-8-23)33(35)37(43)25-11-13-26(14-12-25)38(44)34-32(24-9-5-2-6-10-24)36(34)40(46)28-17-21-30(42)22-18-28/h1-22,31-36H
InChIKey ROFIBCKPBIVVTF-UHFFFAOYSA-N
Molecular Weight 643.566 g/mol
SMILES C1(C(C(c2ccc(Cl)cc2)=O)C1c1ccccc1)C(c1ccc(C(C2C(C(c3ccc(cc3)Cl)=O)C2c2ccccc2)=O)cc1)=O
SPLASH splash10-000i-0948010000-b7accabdc8432c498019
Source of Spectrum G-58-1442-0
Wiley ID 748661