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3-Phenylpropyl 4-(3,4-dichlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate
SpectraBase Compound ID Kx0TTwyhOtv
InChI InChI=1S/C22H21Cl2NO3/c1-14-21(22(27)28-11-5-8-15-6-3-2-4-7-15)17(13-20(26)25-14)16-9-10-18(23)19(24)12-16/h2-4,6-7,9-10,12,17H,5,8,11,13H2,1H3,(H,25,26)
InChIKey IKCNEGHZVLZHOQ-UHFFFAOYSA-N
Mol Weight 418.32 g/mol
Molecular Formula C22H21Cl2NO3
Exact Mass 417.089849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J02qnOWOOtF
Name 3-Phenylpropyl 4-(3,4-dichlorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate
CAS Registry Number 346725-37-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21Cl2NO3
InChI InChI=1S/C22H21Cl2NO3/c1-14-21(22(27)28-11-5-8-15-6-3-2-4-7-15)17(13-20(26)25-14)16-9-10-18(23)19(24)12-16/h2-4,6-7,9-10,12,17H,5,8,11,13H2,1H3,(H,25,26)
InChIKey IKCNEGHZVLZHOQ-UHFFFAOYSA-N
Molecular Weight 418.320 g/mol
SMILES N1C(CC(C(=C1C)C(=O)OCCCc1ccccc1)c1cc(Cl)c(cc1)Cl)=O
SPLASH splash10-014i-3930000000-9f822f8de625cc1f3997
Source of Spectrum AD-0-2532-0
Synonyms 3-Phenylpropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate 3-Phenylpropyl 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate 4-(3,4-dichlorophenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyridine-5-carboxylic acid 3-phenylpropyl ester 4-(3,4-dichlorophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid 3-phenylpropyl ester Pyridine-5-carboxylic acid, 1,2,3,4-tetrahydro-4-(3,4-dichlorophenyl)-6-methyl-2-oxo-, 3-phenylpropyl ester
Wiley ID 1422170