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8-Phenylmenthyl 4,5-dihydro-3-(4'-methoxyphenyl)-1,4-diphenyl-1H-pyrazole-5-carboxylate
SpectraBase Compound ID EhWDsjeAfjO
InChI InChI=1S/C39H42N2O3/c1-27-20-25-33(39(2,3)30-16-10-6-11-17-30)34(26-27)44-38(42)37-35(28-14-8-5-9-15-28)36(29-21-23-32(43-4)24-22-29)40-41(37)31-18-12-7-13-19-31/h5-19,21-24,27,33-35,37H,20,25-26H2,1-4H3
InChIKey QUZIDGYTYAQTOK-UHFFFAOYSA-N
Mol Weight 586.8 g/mol
Molecular Formula C39H42N2O3
Exact Mass 586.319543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CyRgau9h72
Name 8-Phenylmenthyl 4,5-dihydro-3-(4'-methoxyphenyl)-1,4-diphenyl-1H-pyrazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H42N2O3
InChI InChI=1S/C39H42N2O3/c1-27-20-25-33(39(2,3)30-16-10-6-11-17-30)34(26-27)44-38(42)37-35(28-14-8-5-9-15-28)36(29-21-23-32(43-4)24-22-29)40-41(37)31-18-12-7-13-19-31/h5-19,21-24,27,33-35,37H,20,25-26H2,1-4H3
InChIKey QUZIDGYTYAQTOK-UHFFFAOYSA-N
Molecular Weight 586.776 g/mol
SMILES C1(N(N=C(C1c1ccccc1)c1ccc(cc1)OC)c1ccccc1)C(OC1C(C(c2ccccc2)(C)C)CCC(C1)C)=O
SPLASH splash10-004r-0009040000-52c38384c8694dbf7d22
Source of Spectrum K1-2000-1781-20
Synonyms 5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexyl 3-(4-methoxyphenyl)-1,4-diphenyl-4,5-dihydro-1H-pyrazole-5-carboxylate
Wiley ID 750277