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1H-pyrazole, 3-[1,1'-biphenyl]-4-yl-4,5-dihydro-1,5-diphenyl-
SpectraBase Compound ID HgOBpYtVmtF
InChI InChI=1S/C27H22N2/c1-4-10-21(11-5-1)22-16-18-23(19-17-22)26-20-27(24-12-6-2-7-13-24)29(28-26)25-14-8-3-9-15-25/h1-19,27H,20H2
InChIKey AQESHMDCMHVRIJ-UHFFFAOYSA-N
Mol Weight 374.49 g/mol
Molecular Formula C27H22N2
Exact Mass 374.178299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ta84XD19xK
Name 1H-Pyrazole, 3-[1,1'-biphenyl]-4-yl-4,5-dihydro-1,5-diphenyl-
Comments Computed using HOSE algorithm
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Exact Mass 374.178298716 u
Formula C27H22N2
InChI InChI=1S/C27H22N2/c1-4-10-21(11-5-1)22-16-18-23(19-17-22)26-20-27(24-12-6-2-7-13-24)29(28-26)25-14-8-3-9-15-25/h1-19,27H,20H2
InChIKey AQESHMDCMHVRIJ-UHFFFAOYSA-N
Molecular Weight 374.487 g/mol
SMILES C=1C=CC(N2N=C(CC2C=2C=CC=CC2)C2=CC=C(C=C2)C2=CC=CC=C2)=CC1