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Septiphenyl

View entire compound with spectra: 1 MS (GC)

Septiphenyl
SpectraBase Compound ID 7ML0OucwZtx
InChI InChI=1S/C48H42/c1-31-22-34(4)46(43(25-31)37-16-10-7-11-17-37)40-28-41(47-35(5)23-32(2)26-44(47)38-18-12-8-13-19-38)30-42(29-40)48-36(6)24-33(3)27-45(48)39-20-14-9-15-21-39/h7-30H,1-6H3
InChIKey XSUCCAMSHAKQJJ-UHFFFAOYSA-N
Mol Weight 618.9 g/mol
Molecular Formula C48H42
Exact Mass 618.328651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BV5ZgM2tDgf
Name Septiphenyl
Alternate Name(s) 1,3,5-tris(2,4-dimethyl-6-phenylphenyl)benzene 1,3,5-tris[3',5'-Dimethylbiphenyl-2'-yl]-benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H42
InChI InChI=1S/C48H42/c1-31-22-34(4)46(43(25-31)37-16-10-7-11-17-37)40-28-41(47-35(5)23-32(2)26-44(47)38-18-12-8-13-19-38)30-42(29-40)48-36(6)24-33(3)27-45(48)39-20-14-9-15-21-39/h7-30H,1-6H3
InChIKey XSUCCAMSHAKQJJ-UHFFFAOYSA-N
Molecular Weight 618.864 g/mol
SMILES c1(cc(cc(c1)-c1c(-c2ccccc2)cc(cc1C)C)-c1c(-c2ccccc2)cc(cc1C)C)-c1c(-c2ccccc2)cc(cc1C)C
SPLASH splash10-014i-0100009000-5eef58f9f60caedc92cc
Source of Spectrum D1-2006-2919-13
Wiley ID 1614263