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4-Butyl-4-methyl-1,2-diphenyl-3,5-pyrazolidinedione
SpectraBase Compound ID KB11VxhmnfR
InChI InChI=1S/C20H22N2O2/c1-3-4-15-20(2)18(23)21(16-11-7-5-8-12-16)22(19(20)24)17-13-9-6-10-14-17/h5-14H,3-4,15H2,1-2H3
InChIKey QBXQDSFAILUQAX-UHFFFAOYSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Sjr8856S8
Name 4-Butyl-4-methyl-1,2-diphenyl-3,5-pyrazolidinedione
Alternate Name(s) 4-Butyl-4-methyl-1,2-diphenyl-pyrazolidine-3,5-dione 4-Butyl-4-methyl-1,2-diphenyl-pyrazolidine-3,5-quinone
CAS Registry Number 26598-82-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-3-4-15-20(2)18(23)21(16-11-7-5-8-12-16)22(19(20)24)17-13-9-6-10-14-17/h5-14H,3-4,15H2,1-2H3
InChIKey QBXQDSFAILUQAX-UHFFFAOYSA-N
Molecular Weight 322.408 g/mol
SMILES C1(N(N(C(C1(CCCC)C)=O)c1ccccc1)c1ccccc1)=O
SPLASH splash10-002b-7913000000-427796a670efc8de962d
Source of Spectrum O-10-607-1
Wiley ID 1321958