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Chlorobenzoic acid, methyl ester
SpectraBase Compound ID 972nIIBb2xe
InChI InChI=1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey LXNFVVDCCWUUKC-UHFFFAOYSA-N
Mol Weight 170.59 g/mol
Molecular Formula C8H7ClO2
Exact Mass 170.013457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUFHgNOFu1R
Name Chlorobenzoic acid, methyl ester
Comments (from INDOMETHACIN)
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Formula C8H7ClO2
InChI InChI=1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey LXNFVVDCCWUUKC-UHFFFAOYSA-N
SMILES c1(C(=O)OC)ccc(cc1)Cl
SPLASH splash10-01p9-3900000000-c3e73d48e1f3aae0e3f1
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences