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3-(3,6-diphenyl-1,6-dihydro-1-pyridazyl)-3-oxo-2,2-di-ethylpropionic acid
SpectraBase Compound ID KjUtCtN1LJL
InChI InChI=1S/C23H24N2O3/c1-3-23(4-2,22(27)28)21(26)25-20(18-13-9-6-10-14-18)16-15-19(24-25)17-11-7-5-8-12-17/h5-16,20H,3-4H2,1-2H3,(H,27,28)
InChIKey ZGFGPWPEANSISY-UHFFFAOYSA-N
Mol Weight 376.46 g/mol
Molecular Formula C23H24N2O3
Exact Mass 376.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyMGDaAebdV
Name 3-(3,6-diphenyl-1,6-dihydro-1-pyridazyl)-3-oxo-2,2-di-ethylpropionic acid
CAS Registry Number 105140-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24N2O3
InChI InChI=1S/C23H24N2O3/c1-3-23(4-2,22(27)28)21(26)25-20(18-13-9-6-10-14-18)16-15-19(24-25)17-11-7-5-8-12-17/h5-16,20H,3-4H2,1-2H3,(H,27,28)
InChIKey ZGFGPWPEANSISY-UHFFFAOYSA-N
Molecular Weight 376.456 g/mol
SMILES OC(C(C(N1N=C(c2ccccc2)C=CC1c1ccccc1)=O)(CC)CC)=O
SPLASH splash10-0kai-1960000000-8a00ad273d68a69b7563
Source of Spectrum J-52-103-8
Synonyms 2-[(3,6-diphenyl-1(6H)-pyridazinyl)carbonyl]-2-ethylbutanoic acid
Wiley ID 1357933