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Ethyl (Z)-4-chloro-7-cyano-2-oxo-3-heptenoate
SpectraBase Compound ID 4XxHKUaajR3
InChI InChI=1S/C10H12ClNO3/c1-2-15-10(14)9(13)7-8(11)5-3-4-6-12/h7H,2-5H2,1H3/b8-7-
InChIKey JXYVFMVZZIYIPK-FPLPWBNLSA-N
Mol Weight 229.66 g/mol
Molecular Formula C10H12ClNO3
Exact Mass 229.050571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3vZOnmDxooB
Name Ethyl (Z)-4-chloro-7-cyano-2-oxo-3-heptenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12ClNO3
InChI InChI=1S/C10H12ClNO3/c1-2-15-10(14)9(13)7-8(11)5-3-4-6-12/h7H,2-5H2,1H3/b8-7-
InChIKey JXYVFMVZZIYIPK-FPLPWBNLSA-N
Molecular Weight 229.663 g/mol
SMILES C(C(\C=C\(CCCC#N)Cl)=O)(=O)OCC
SPLASH splash10-0aor-3900000000-cdbdbb94a7393dcbde76
Source of Spectrum QE-11-3628-3
Synonyms Ethyl (3Z)-4-chloro-7-cyano-2-oxo-3-heptenoate
Wiley ID 1638830