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3-Methyl-1,4,6-triphenyl-4,5-dihydro-1H-indazole

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-Methyl-1,4,6-triphenyl-4,5-dihydro-1H-indazole
SpectraBase Compound ID KSSHPppTvf8
InChI InChI=1S/C26H22N2/c1-19-26-24(21-13-7-3-8-14-21)17-22(20-11-5-2-6-12-20)18-25(26)28(27-19)23-15-9-4-10-16-23/h2-16,18,24H,17H2,1H3
InChIKey DXNURCRRGKRFQK-UHFFFAOYSA-N
Mol Weight 362.48 g/mol
Molecular Formula C26H22N2
Exact Mass 362.178299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 36eBX6rFxmy
Name 3-Methyl-1,4,6-triphenyl-4,5-dihydro-1H-indazole
Comments Computed using HOSE algorithm
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Exact Mass 362.178298716 u
Formula C26H22N2
InChI InChI=1S/C26H22N2/c1-19-26-24(21-13-7-3-8-14-21)17-22(20-11-5-2-6-12-20)18-25(26)28(27-19)23-15-9-4-10-16-23/h2-16,18,24H,17H2,1H3
InChIKey DXNURCRRGKRFQK-UHFFFAOYSA-N
Molecular Weight 362.476 g/mol
SMILES C12=C(C(C)=NN2C2=CC=CC=C2)C(C2=CC=CC=C2)CC(=C1)C=1C=CC=CC1