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(3R)-3-(4-chlorophenyl)-3-cyano-propionic acid ethyl ester
SpectraBase Compound ID Ekq7AsqaqSw
InChI InChI=1S/C12H12ClNO2/c1-2-16-12(15)7-10(8-14)9-3-5-11(13)6-4-9/h3-6,10H,2,7H2,1H3/t10-/m0/s1
InChIKey XEZYVIMQKOFWRH-JTQLQIEISA-N
Mol Weight 237.69 g/mol
Molecular Formula C12H12ClNO2
Exact Mass 237.055656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66DWmpizNGA
Name (3R)-3-(4-chlorophenyl)-3-cyano-propionic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClNO2
InChI InChI=1S/C12H12ClNO2/c1-2-16-12(15)7-10(8-14)9-3-5-11(13)6-4-9/h3-6,10H,2,7H2,1H3/t10-/m0/s1
InChIKey XEZYVIMQKOFWRH-JTQLQIEISA-N
Molecular Weight 237.686 g/mol
SMILES C(#N)[C@](CC(=O)OCC)(c1ccc(cc1)Cl)[H]
SPLASH splash10-01t9-9400000000-31e506dfd2632fba299b
Source of Spectrum KD-14-586-3
Synonyms (3R)-3-(4-chlorophenyl)-3-cyanopropanoic acid ethyl ester Ethyl (3R)-3-(4-chlorophenyl)-3-cyano-propanoate
Wiley ID 1635886