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(R)-2-Benzyl-4-(3-ethyl-5-hydroxy-1-phenyl-1H-pyrazol-4-yl)-2-methylcyclopent-4-ene-1,3-dione
SpectraBase Compound ID 4TU9CHiROut
InChI InChI=1S/C24H22N2O3/c1-3-19-21(23(29)26(25-19)17-12-8-5-9-13-17)18-14-20(27)24(2,22(18)28)15-16-10-6-4-7-11-16/h4-14,29H,3,15H2,1-2H3/t24-/m1/s1
InChIKey QKKFQAZMULRBAN-XMMPIXPASA-N
Mol Weight 386.45 g/mol
Molecular Formula C24H22N2O3
Exact Mass 386.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58UCc75n0Ab
Name (R)-2-Benzyl-4-(3-ethyl-5-hydroxy-1-phenyl-1H-pyrazol-4-yl)-2-methylcyclopent-4-ene-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N2O3
InChI InChI=1S/C24H22N2O3/c1-3-19-21(23(29)26(25-19)17-12-8-5-9-13-17)18-14-20(27)24(2,22(18)28)15-16-10-6-4-7-11-16/h4-14,29H,3,15H2,1-2H3/t24-/m1/s1
InChIKey QKKFQAZMULRBAN-XMMPIXPASA-N
Literature Reference DOI 10.1002/adsc.201700917
Molecular Weight 386.451 g/mol
SMILES Oc1[n](nc(c1C1=CC([C@@](Cc2ccccc2)(C1=O)C)=O)CC)-c1ccccc1
SPLASH splash10-000m-6079000000-4f07f53645d2854d9da7
Source of Spectrum ASC-359-SM16-3j
Wiley ID 1811569