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2-Propenoic acid, 3-chloro-2-formyl-3-(4-nitrophenyl)-, methyl ester, (E)-
SpectraBase Compound ID FS6N9kpHiEv
InChI InChI=1S/C11H8ClNO5/c1-18-11(15)9(6-14)10(12)7-2-4-8(5-3-7)13(16)17/h2-6H,1H3/b10-9+
InChIKey WCKKKJAIEFSXKI-MDZDMXLPSA-N
Mol Weight 269.64 g/mol
Molecular Formula C11H8ClNO5
Exact Mass 269.0091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LB662QraEMS
Name 2-Propenoic acid, 3-chloro-2-formyl-3-(4-nitrophenyl)-, methyl ester, (E)-
CAS Registry Number 106098-04-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8ClNO5
InChI InChI=1S/C11H8ClNO5/c1-18-11(15)9(6-14)10(12)7-2-4-8(5-3-7)13(16)17/h2-6H,1H3/b10-9+
InChIKey WCKKKJAIEFSXKI-MDZDMXLPSA-N
Molecular Weight 269.640 g/mol
SMILES c1(\C(=C/(C(=O)OC)C=O)Cl)ccc(N(=O)=O)cc1
SPLASH splash10-05g0-0890000000-f647644c85c90e3345ef
Source of Spectrum J-51-4126-0
Synonyms (E)-.beta.-chloro-.alpha.-(methoxycarbonyl)-p-nitrocinnamaldehydes Methyl (2E)-3-chloro-2-formyl-3-(4-nitrophenyl)-2-propenoate
Wiley ID 1272977