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2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,1,2-triphenylethanol
SpectraBase Compound ID HReO9iRDafX
InChI InChI=1S/C25H24N2O/c1-19-18-20(2)27(26-19)24(21-12-6-3-7-13-21)25(28,22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-18,24,28H,1-2H3
InChIKey MRYIEECJHRGVFZ-UHFFFAOYSA-N
Mol Weight 368.48 g/mol
Molecular Formula C25H24N2O
Exact Mass 368.188863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4rQOUWDM0ce
Name 2-(3,5-Dimethyl-1H-pyrazol-1-yl)-1,1,2-triphenylethanol
Comments Computed using HOSE algorithm
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Exact Mass 368.188863400 u
Formula C25H24N2O
InChI InChI=1S/C25H24N2O/c1-19-18-20(2)27(26-19)24(21-12-6-3-7-13-21)25(28,22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-18,24,28H,1-2H3
InChIKey MRYIEECJHRGVFZ-UHFFFAOYSA-N
Molecular Weight 368.480 g/mol
SMILES OC(C(N1N=C(C)C=C1C)C1=CC=CC=C1)(C=1C=CC=CC1)C=1C=CC=CC1