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Hexaphenylbenzene
SpectraBase Compound ID KgiNM61Sar1
InChI InChI=1S/C42H30/c1-7-19-31(20-8-1)37-38(32-21-9-2-10-22-32)40(34-25-13-4-14-26-34)42(36-29-17-6-18-30-36)41(35-27-15-5-16-28-35)39(37)33-23-11-3-12-24-33/h1-30H
InChIKey QBHWPVJPWQGYDS-UHFFFAOYSA-N
Mol Weight 534.7 g/mol
Molecular Formula C42H30
Exact Mass 534.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LshEuIEqt6P
Name 1,1':2',1''-Terphenyl, 3',4',5',6'-tetraphenyl-
Alternate Name(s) 1,2,3,4,5,6-hexakis-phenylbenzene 3',4',5',6'-Tetraphenyl-O-terphenyl Benzene, hexaphenyl- m-Terphenyl, 2',4',5',6'-tetraphenyl- EINECS 213-591-7
CAS Registry Number 992-04-1
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Formula C42H30
InChI InChI=1S/C42H30/c1-7-19-31(20-8-1)37-38(32-21-9-2-10-22-32)40(34-25-13-4-14-26-34)42(36-29-17-6-18-30-36)41(35-27-15-5-16-28-35)39(37)33-23-11-3-12-24-33/h1-30H
InChIKey QBHWPVJPWQGYDS-UHFFFAOYSA-N
Molecular Weight 534.702 g/mol
SMILES c1(-c2c(c(-c3ccccc3)c(c(c2-c2ccccc2)-c2ccccc2)-c2ccccc2)-c2ccccc2)ccccc1
SPLASH splash10-001r-0132290000-4d1badcb47720b28bc39
Source of Spectrum HE-1982-0-0
Wiley ID 1403915