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trans-2-Benzyl-2-(2-methylpropenyl)-1,1-diphenyl-3-(2,2-diphenylvinyl)cyclopropane
SpectraBase Compound ID 3YYoFgiYE0n
InChI InChI=1S/C40H36/c1-31(2)29-39(30-32-18-8-3-9-19-32)38(28-37(33-20-10-4-11-21-33)34-22-12-5-13-23-34)40(39,35-24-14-6-15-25-35)36-26-16-7-17-27-36/h3-29,38H,30H2,1-2H3/t38-,39+/m1/s1
InChIKey NSAWZQCGODDBGD-RGULYWFUSA-N
Mol Weight 516.7 g/mol
Molecular Formula C40H36
Exact Mass 516.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkArUnA5aD0
Name trans-2-Benzyl-2-(2-methylpropenyl)-1,1-diphenyl-3-(2,2-diphenylvinyl)cyclopropane
Alternate Name(s) [(2R,3R)-2-benzyl-3-(2,2-diphenylvinyl)-2-(2-methyl-1-propenyl)-1-phenylcyclopropyl]benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H36
InChI InChI=1S/C40H36/c1-31(2)29-39(30-32-18-8-3-9-19-32)38(28-37(33-20-10-4-11-21-33)34-22-12-5-13-23-34)40(39,35-24-14-6-15-25-35)36-26-16-7-17-27-36/h3-29,38H,30H2,1-2H3/t38-,39+/m1/s1
InChIKey NSAWZQCGODDBGD-RGULYWFUSA-N
Molecular Weight 516.728 g/mol
SMILES [C@@]1([C@@](C=C(c2ccccc2)c2ccccc2)(C1(c1ccccc1)c1ccccc1)[H])(C=C(C)C)Cc1ccccc1
SPLASH splash10-00or-0510910000-fd0e321d655977b788ae
Source of Spectrum F-68-5064-22
Wiley ID 1572814