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(R)-2-Benzyl-4-(5-hydroxy-1,3-dimethyl-1H-pyrazol-4-yl)-2-methylcyclopent-4-ene-1,3-dione
SpectraBase Compound ID 2UFmKk4xAq0
InChI InChI=1S/C18H18N2O3/c1-11-15(17(23)20(3)19-11)13-9-14(21)18(2,16(13)22)10-12-7-5-4-6-8-12/h4-9,23H,10H2,1-3H3/t18-/m1/s1
InChIKey NNBDAMXDFSDENE-GOSISDBHSA-N
Mol Weight 310.35 g/mol
Molecular Formula C18H18N2O3
Exact Mass 310.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bmPZodDkrN
Name (R)-2-Benzyl-4-(5-hydroxy-1,3-dimethyl-1H-pyrazol-4-yl)-2-methylcyclopent-4-ene-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O3
InChI InChI=1S/C18H18N2O3/c1-11-15(17(23)20(3)19-11)13-9-14(21)18(2,16(13)22)10-12-7-5-4-6-8-12/h4-9,23H,10H2,1-3H3/t18-/m1/s1
InChIKey NNBDAMXDFSDENE-GOSISDBHSA-N
Literature Reference DOI 10.1002/adsc.201700917
Molecular Weight 310.353 g/mol
SMILES Oc1[n](nc(c1C1=CC([C@@](Cc2ccccc2)(C1=O)C)=O)C)C
SPLASH splash10-03di-3049000000-5addba7048343f36b436
Source of Spectrum ASC-359-SM15-3h
Wiley ID 1811567