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1,2,4-Triphenyl-3-(2,5-xylyl)naphthalene

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

1,2,4-Triphenyl-3-(2,5-xylyl)naphthalene
SpectraBase Compound ID JxeEy3sGxrm
InChI InChI=1S/C36H28/c1-25-22-23-26(2)32(24-25)36-34(28-16-8-4-9-17-28)31-21-13-12-20-30(31)33(27-14-6-3-7-15-27)35(36)29-18-10-5-11-19-29/h3-24H,1-2H3
InChIKey NPWMZZXWPNOEAT-UHFFFAOYSA-N
Mol Weight 460.6 g/mol
Molecular Formula C36H28
Exact Mass 460.219101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 81lshnQdzT9
Name 1,2,4-Triphenyl-3-(2,5-xylyl)naphthalene
Comments Computed using HOSE algorithm
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Exact Mass 460.219100902 u
Formula C36H28
InChI InChI=1S/C36H28/c1-25-22-23-26(2)32(24-25)36-34(28-16-8-4-9-17-28)31-21-13-12-20-30(31)33(27-14-6-3-7-15-27)35(36)29-18-10-5-11-19-29/h3-24H,1-2H3
InChIKey NPWMZZXWPNOEAT-UHFFFAOYSA-N
Molecular Weight 460.620 g/mol
SMILES C=12C=CC=CC1C(=C(C(=C2C=1C=CC=CC1)C=1C=CC=CC1)C=1C(=CC=C(C1)C)C)C=1C=CC=CC1