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[(o-Chlorobenzylidene)cyano]acetic acid
SpectraBase Compound ID Grhig0Y2dMQ
InChI InChI=1S/C10H6ClNO2/c11-9-4-2-1-3-7(9)5-8(6-12)10(13)14/h1-5H,(H,13,14)/b8-5+
InChIKey SPTXWNXTYIDOON-VMPITWQZSA-N
Mol Weight 207.62 g/mol
Molecular Formula C10H6ClNO2
Exact Mass 207.008706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ib02mr0Fl82
Name [(o-Chlorobenzylidene)cyano]acetic acid
Alternate Name(s) (E)-3-(2-Chloro-phenyl)-2-cyano-acrylic acid (E)-3-(2-chlorophenyl)-2-cyano-2-propenoic acid (E)-3-(2-chlorophenyl)-2-cyanoprop-2-enoic acid (E)-3-(2-chlorophenyl)-2-cyano-prop-2-enoic acid
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Formula C10H6ClNO2
InChI InChI=1S/C10H6ClNO2/c11-9-4-2-1-3-7(9)5-8(6-12)10(13)14/h1-5H,(H,13,14)/b8-5+
InChIKey SPTXWNXTYIDOON-VMPITWQZSA-N
Molecular Weight 207.616 g/mol
SMILES OC(\C(=C\c1c(Cl)cccc1)C#N)=O
SPLASH splash10-00di-0900000000-0a9bf2f382c4852e4144
Source of Spectrum SK-28-4661-7
Wiley ID 880293