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Pimelic acid, 2,3,4,6-tetrachlorophenyl propyl ester
SpectraBase Compound ID G4rangbxSKP
InChI InChI=1S/C16H18Cl4O4/c1-2-8-23-12(21)6-4-3-5-7-13(22)24-16-11(18)9-10(17)14(19)15(16)20/h9H,2-8H2,1H3
InChIKey OJKZGUYAFIQROR-UHFFFAOYSA-N
Mol Weight 416.1 g/mol
Molecular Formula C16H18Cl4O4
Exact Mass 413.99592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4rnvfQBZZX
Name Pimelic acid, 2,3,4,6-tetrachlorophenyl propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18Cl4O4
InChI InChI=1S/C16H18Cl4O4/c1-2-8-23-12(21)6-4-3-5-7-13(22)24-16-11(18)9-10(17)14(19)15(16)20/h9H,2-8H2,1H3
InChIKey OJKZGUYAFIQROR-UHFFFAOYSA-N
Molecular Weight 416.128 g/mol
SMILES C(CCCCCC(Oc1c(c(c(cc1Cl)Cl)Cl)Cl)=O)(OCCC)=O
SPLASH splash10-004l-7910000000-bdbc57688240c3b31b40
Source of Spectrum TIPS-2022-543-0
Wiley ID 1822060