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(Z)-methyl 3-[(2S*,3S*)-2,4-di(4-chlorophenyl)-2,3-dihydro-6-oxopyrid-3-yl]propenoate
SpectraBase Compound ID F2FBMkkfans
InChI InChI=1S/C21H17Cl2NO3/c1-27-20(26)11-10-17-18(13-2-6-15(22)7-3-13)12-19(25)24-21(17)14-4-8-16(23)9-5-14/h2-12,17,21H,1H3,(H,24,25)/b11-10-/t17-,21+/m0/s1
InChIKey GJSCHKUWBLNUDG-RZYBSXKYSA-N
Mol Weight 402.28 g/mol
Molecular Formula C21H17Cl2NO3
Exact Mass 401.058549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ihq52aNE4iZ
Name (Z)-methyl 3-[(2S*,3S*)-2,4-di(4-chlorophenyl)-2,3-dihydro-6-oxopyrid-3-yl]propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17Cl2NO3
InChI InChI=1S/C21H17Cl2NO3/c1-27-20(26)11-10-17-18(13-2-6-15(22)7-3-13)12-19(25)24-21(17)14-4-8-16(23)9-5-14/h2-12,17,21H,1H3,(H,24,25)/b11-10-/t17-,21+/m0/s1
InChIKey GJSCHKUWBLNUDG-RZYBSXKYSA-N
Literature Reference DOI 10.1021/ol202046y
Molecular Weight 402.277 g/mol
SMILES N1[C@@]([C@](C(=CC1=O)c1ccc(cc1)Cl)(\C=C/C(OC)=O)[H])(c1ccc(cc1)Cl)[H]
SPLASH splash10-0j70-0792400000-178f6ababef715413941
Source of Spectrum A1-13-5172/SMS22-13h
Synonyms (Z)-methyl 3-((2S,3S)-2,4-bis(4-chlorophenyl)-6-oxo-1,2,3,6-tetrahydropyridin-3-yl)acrylate
Wiley ID 1753763