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Indomethacin
SpectraBase Compound ID 3GhWVCuH0IH
InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
InChIKey CGIGDMFJXJATDK-UHFFFAOYSA-N
Mol Weight 357.79 g/mol
Molecular Formula C19H16ClNO4
Exact Mass 357.076786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WUm63zipnf
Name Indomethacin
Comments (unverified)
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Formula C19H16ClNO4
InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
InChIKey CGIGDMFJXJATDK-UHFFFAOYSA-N
SMILES OC(Cc1c2cc(ccc2[n](c1C)C(c1ccc(cc1)Cl)=O)OC)=O
SPLASH splash10-000i-1901000000-86fa9ae46026c23857c2
Source of Spectrum Mass Spectrometry Committee of the Toxicology Section of the American Academy of Forensic Sciences