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Pimelic acid, 2,3,6-trichlorophenyl propyl ester
SpectraBase Compound ID F6RN23jEPHV
InChI InChI=1S/C16H19Cl3O4/c1-2-10-22-13(20)6-4-3-5-7-14(21)23-16-12(18)9-8-11(17)15(16)19/h8-9H,2-7,10H2,1H3
InChIKey WIHHNHHUNUFIRZ-UHFFFAOYSA-N
Mol Weight 381.68 g/mol
Molecular Formula C16H19Cl3O4
Exact Mass 380.034892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3639bNCjBb4
Name Pimelic acid, 2,3,6-trichlorophenyl propyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19Cl3O4
InChI InChI=1S/C16H19Cl3O4/c1-2-10-22-13(20)6-4-3-5-7-14(21)23-16-12(18)9-8-11(17)15(16)19/h8-9H,2-7,10H2,1H3
InChIKey WIHHNHHUNUFIRZ-UHFFFAOYSA-N
Molecular Weight 381.683 g/mol
SMILES C(CCCCCC(Oc1c(c(ccc1Cl)Cl)Cl)=O)(OCCC)=O
SPLASH splash10-00ou-8900000000-1cc1d1b453b021583206
Source of Spectrum TIPS-2022-581-0
Wiley ID 1822098