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2-(4-Biphenylyl)-6,7-dimethyl-1,3,4-triphenylnaphthalene
SpectraBase Compound ID hU0M17b5py
InChI InChI=1S/C42H32/c1-29-27-37-38(28-30(29)2)40(34-19-11-5-12-20-34)42(36-25-23-32(24-26-36)31-15-7-3-8-16-31)41(35-21-13-6-14-22-35)39(37)33-17-9-4-10-18-33/h3-28H,1-2H3
InChIKey YRZLFWKSDUXDAZ-UHFFFAOYSA-N
Mol Weight 536.7 g/mol
Molecular Formula C42H32
Exact Mass 536.250401 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7GzpSFwciFn
Name 2-(4-Biphenylyl)-6,7-dimethyl-1,3,4-triphenylnaphthalene
Comments Computed using HOSE algorithm
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Exact Mass 536.250401030 u
Formula C42H32
InChI InChI=1S/C42H32/c1-29-27-37-38(28-30(29)2)40(34-19-11-5-12-20-34)42(36-25-23-32(24-26-36)31-15-7-3-8-16-31)41(35-21-13-6-14-22-35)39(37)33-17-9-4-10-18-33/h3-28H,1-2H3
InChIKey YRZLFWKSDUXDAZ-UHFFFAOYSA-N
Molecular Weight 536.718 g/mol
SMILES C=12C=C(C(=CC1C(=C(C(=C2C=1C=CC=CC1)C=1C=CC(=CC1)C=1C=CC=CC1)C=1C=CC=CC1)C=1C=CC=CC1)C)C