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(1R,3R,4S)-8-Phenylmenthyl (4R,5S)-4,5-Dihydro-1,3,4-triphenyl-1H-pyrazole-5-carboxylate
SpectraBase Compound ID JiyOBW9J6ke
InChI InChI=1S/C38H40N2O2/c1-27-24-25-32(38(2,3)30-20-12-6-13-21-30)33(26-27)42-37(41)36-34(28-16-8-4-9-17-28)35(29-18-10-5-11-19-29)39-40(36)31-22-14-7-15-23-31/h4-23,27,32-34,36H,24-26H2,1-3H3/t27-,32-,33-,34+,36+/m1/s1
InChIKey DYEWHNCLRFYFNS-KJACCEMDSA-N
Mol Weight 556.8 g/mol
Molecular Formula C38H40N2O2
Exact Mass 556.308979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20tsWi2s67O
Name (1R,3R,4S)-8-Phenylmenthyl (4R,5S)-4,5-Dihydro-1,3,4-triphenyl-1H-pyrazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H40N2O2
InChI InChI=1S/C38H40N2O2/c1-27-24-25-32(38(2,3)30-20-12-6-13-21-30)33(26-27)42-37(41)36-34(28-16-8-4-9-17-28)35(29-18-10-5-11-19-29)39-40(36)31-22-14-7-15-23-31/h4-23,27,32-34,36H,24-26H2,1-3H3/t27-,32-,33-,34+,36+/m1/s1
InChIKey DYEWHNCLRFYFNS-KJACCEMDSA-N
Molecular Weight 556.750 g/mol
SMILES [C@]1(N(N=C([C@@]1(c1ccccc1)[H])c1ccccc1)c1ccccc1)(C(O[C@]1([C@](C(c2ccccc2)(C)C)(CC[C@](C1)(C)[H])[H])[H])=O)[H]
SPLASH splash10-0002-0093020000-96ad3083768217a0a332
Source of Spectrum K1-2000-1781-20a
Wiley ID 750279