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1,1,1,3,3,3-Hexaphenylpropane

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

1,1,1,3,3,3-Hexaphenylpropane
SpectraBase Compound ID LIeaghAiREA
InChI InChI=1S/C39H32/c1-7-19-32(20-8-1)38(33-21-9-2-10-22-33,34-23-11-3-12-24-34)31-39(35-25-13-4-14-26-35,36-27-15-5-16-28-36)37-29-17-6-18-30-37/h1-30H,31H2
InChIKey UVUJLQFGSIDCPN-UHFFFAOYSA-N
Mol Weight 500.7 g/mol
Molecular Formula C39H32
Exact Mass 500.250401 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID ohSWLNw8fV
Name 1,1,1,3,3,3-Hexaphenylpropane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.250401030 u
Formula C39H32
InChI InChI=1S/C39H32/c1-7-19-32(20-8-1)38(33-21-9-2-10-22-33,34-23-11-3-12-24-34)31-39(35-25-13-4-14-26-35,36-27-15-5-16-28-36)37-29-17-6-18-30-37/h1-30H,31H2
InChIKey UVUJLQFGSIDCPN-UHFFFAOYSA-N
Molecular Weight 500.685 g/mol
SMILES C=1C(=CC=CC1)C(C=1C=CC=CC1)(C=1C=CC=CC1)CC(C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.998727