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Menthyl 4,5-dihydro-1,4-diphenyl-3-(4'-methoxyphenyl)-1H-pyrazole-5-carboxylate

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Menthyl 4,5-dihydro-1,4-diphenyl-3-(4'-methoxyphenyl)-1H-pyrazole-5-carboxylate
SpectraBase Compound ID OlxIndBewI
InChI InChI=1S/C33H38N2O3/c1-22(2)28-20-15-23(3)21-29(28)38-33(36)32-30(24-11-7-5-8-12-24)31(25-16-18-27(37-4)19-17-25)34-35(32)26-13-9-6-10-14-26/h5-14,16-19,22-23,28-30,32H,15,20-21H2,1-4H3
InChIKey IYPXMKMBNQIZQU-UHFFFAOYSA-N
Mol Weight 510.7 g/mol
Molecular Formula C33H38N2O3
Exact Mass 510.288243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2YFn7AgSAki
Name Menthyl 4,5-dihydro-1,4-diphenyl-3-(4'-methoxyphenyl)-1H-pyrazole-5-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 510.288243089 u
Formula C33H38N2O3
InChI InChI=1S/C33H38N2O3/c1-22(2)28-20-15-23(3)21-29(28)38-33(36)32-30(24-11-7-5-8-12-24)31(25-16-18-27(37-4)19-17-25)34-35(32)26-13-9-6-10-14-26/h5-14,16-19,22-23,28-30,32H,15,20-21H2,1-4H3
InChIKey IYPXMKMBNQIZQU-UHFFFAOYSA-N
Molecular Weight 510.678 g/mol
SMILES C1(N(N=C(C1C=1C=CC=CC1)C=1C=CC(=CC1)OC)C1=CC=CC=C1)C(OC1C(CCC(C1)C)C(C)C)=O