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2,2,2-trichloro-1-[5-(4-methoxybenzoyl)-1H-pyrrol-2-yl]ethanone
SpectraBase Compound ID KXsZHr8doIe
InChI InChI=1S/C14H10Cl3NO3/c1-21-9-4-2-8(3-5-9)12(19)10-6-7-11(18-10)13(20)14(15,16)17/h2-7,18H,1H3
InChIKey BGBHQGQQTUTAHI-UHFFFAOYSA-N
Mol Weight 346.6 g/mol
Molecular Formula C14H10Cl3NO3
Exact Mass 344.972626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0z22XYrtRx
Name 2,2,2-trichloro-1-[5-(4-methoxybenzoyl)-1H-pyrrol-2-yl]ethanone
Alternate Name(s) 2,2,2-trichloro-1-[5-[(4-methoxyphenyl)-oxomethyl]-1H-pyrrol-2-yl]ethanone 2,2,2-tris(chloranyl)-1-[5-(4-methoxyphenyl)carbonyl-1H-pyrrol-2-yl]ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C14H10Cl3NO3
InChI InChI=1S/C14H10Cl3NO3/c1-21-9-4-2-8(3-5-9)12(19)10-6-7-11(18-10)13(20)14(15,16)17/h2-7,18H,1H3
InChIKey BGBHQGQQTUTAHI-UHFFFAOYSA-N
Molecular Weight 346.597 g/mol
SMILES [nH]1c(ccc1C(C(Cl)(Cl)Cl)=O)C(c1ccc(cc1)OC)=O
SPLASH splash10-00di-0901000000-1d40f730b0f1f4061e50
Source of Spectrum E1-44-53-19
Wiley ID 1553237