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Hexaphenylbenzene

View entire compound with spectra: 7 NMR, 4 FTIR, 2 Raman, and 3 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lu5D1FUgwmW
Name Hexaphenyl-benzene
CAS Registry Number 992-04-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
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
Instrument Name Bruker WH-90
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3