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Pimelic acid, 2,4,5-trichlorophenyl hexyl ester
SpectraBase Compound ID 2fwEuO5mI7
InChI InChI=1S/C19H25Cl3O4/c1-2-3-4-8-11-25-18(23)9-6-5-7-10-19(24)26-17-13-15(21)14(20)12-16(17)22/h12-13H,2-11H2,1H3
InChIKey AVULZPBYACWLIH-UHFFFAOYSA-N
Mol Weight 423.76 g/mol
Molecular Formula C19H25Cl3O4
Exact Mass 422.081842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFPEkOznIwz
Name Pimelic acid, 2,4,5-trichlorophenyl hexyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25Cl3O4
InChI InChI=1S/C19H25Cl3O4/c1-2-3-4-8-11-25-18(23)9-6-5-7-10-19(24)26-17-13-15(21)14(20)12-16(17)22/h12-13H,2-11H2,1H3
InChIKey AVULZPBYACWLIH-UHFFFAOYSA-N
Molecular Weight 423.764 g/mol
SMILES C(CCCCCC(Oc1c(cc(c(c1)Cl)Cl)Cl)=O)(OCCCCCC)=O
SPLASH splash10-002f-9710000000-c186c50b1e5d24d6ee19
Source of Spectrum TIPS-2022-445-0
Wiley ID 1821962