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[2,3-Dichloro-4-(2'-ethyl4'-oxovaleryl)phenoxy]-acetic acid
SpectraBase Compound ID 2lNp7mJam84
InChI InChI=1S/C15H16Cl2O5/c1-3-9(6-8(2)18)15(21)10-4-5-11(14(17)13(10)16)22-7-12(19)20/h4-5,9H,3,6-7H2,1-2H3,(H,19,20)
InChIKey CPGQRGPXPWSEEF-UHFFFAOYSA-N
Mol Weight 347.19 g/mol
Molecular Formula C15H16Cl2O5
Exact Mass 346.037479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbEoT3Lg39e
Name [2,3-Dichloro-4-(2'-ethyl4'-oxovaleryl)phenoxy]-acetic acid
Alternate Name(s) [2,3-dichloro-4-(2-ethyl-4-oxopentanoyl)phenoxy]acetic acid 2-[2,3-dichloro-4-(2-ethyl-1,4-dioxopentyl)phenoxy]acetic acid 2-[2,3-dichloro-4-(2-ethyl-4-oxopentanoyl)phenoxy]acetic acid 2-[2,3-dichloro-4-(2-ethyl-4-oxo-pentanoyl)phenoxy]acetic acid 2-[2,3-bis(chloranyl)-4-(2-ethyl-4-oxidanylidene-pentanoyl)phenoxy]ethanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C15H16Cl2O5
InChI InChI=1S/C15H16Cl2O5/c1-3-9(6-8(2)18)15(21)10-4-5-11(14(17)13(10)16)22-7-12(19)20/h4-5,9H,3,6-7H2,1-2H3,(H,19,20)
InChIKey CPGQRGPXPWSEEF-UHFFFAOYSA-N
Molecular Weight 347.194 g/mol
SMILES OC(COc1ccc(c(c1Cl)Cl)C(C(CC(=O)C)CC)=O)=O
SPLASH splash10-0002-0090000000-b6f8c7bc0cd16e4ee51c
Source of Spectrum D8-324-986-9
Wiley ID 1514255