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Methyl 3-methyl-4-triphenylphosphoranylidene-4,5-dihydropyrazol-5-one-1-carboxylate
SpectraBase Compound ID 5htjHu8Fgia
InChI InChI=1S/C24H21N2O3P/c1-18-22(23(27)26(25-18)24(28)29-2)30(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,1-2H3
InChIKey WAUSDZHOGYNCKM-UHFFFAOYSA-N
Mol Weight 416.42 g/mol
Molecular Formula C24H21N2O3P
Exact Mass 416.12898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dz2tno3StBy
Name Methyl 3-methyl-4-triphenylphosphoranylidene-4,5-dihydropyrazol-5-one-1-carboxylate
Alternate Name(s) methyl 3-methyl-5-oxo-4-(triphenylphosphoranylidene)-4,5-dihydro-1H-pyrazole-1-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N2O3P
InChI InChI=1S/C24H21N2O3P/c1-18-22(23(27)26(25-18)24(28)29-2)30(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,1-2H3
InChIKey WAUSDZHOGYNCKM-UHFFFAOYSA-N
Molecular Weight 416.417 g/mol
SMILES C1(=NN(C(C1=P(c1ccccc1)(c1ccccc1)c1ccccc1)=O)C(=O)OC)C
SPLASH splash10-0a4i-0009000000-855d4346f6202d2a2625
Source of Spectrum KC-57-5859-8
Wiley ID 1624981