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3-(2-Chlorophenyl)-2-cyano-2-methylpropanoic acid
SpectraBase Compound ID JCPWkDYspjT
InChI InChI=1S/C11H10ClNO2/c1-11(7-13,10(14)15)6-8-4-2-3-5-9(8)12/h2-5H,6H2,1H3,(H,14,15)
InChIKey REIVQILOEAOMEJ-UHFFFAOYSA-N
Mol Weight 223.66 g/mol
Molecular Formula C11H10ClNO2
Exact Mass 223.040006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVMAVGGTktP
Name 3-(2-Chlorophenyl)-2-cyano-2-methylpropanoic acid
Alternate Name(s) 3-(2-Chlorophenyl)-2-cyano-2-methyl-propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10ClNO2
InChI InChI=1S/C11H10ClNO2/c1-11(7-13,10(14)15)6-8-4-2-3-5-9(8)12/h2-5H,6H2,1H3,(H,14,15)
InChIKey REIVQILOEAOMEJ-UHFFFAOYSA-N
Molecular Weight 223.659 g/mol
SMILES OC(C(C#N)(Cc1c(Cl)cccc1)C)=O
SPLASH splash10-004i-0900000000-d80b4c031ec58efbeccd
Source of Spectrum KD-14-2140-3
Wiley ID 1636136