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Pimelic acid, di(3,5-dichlorophenyl) ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, di(3,5-dichlorophenyl) ester
SpectraBase Compound ID 1eOnLaKxhQL
InChI InChI=1S/C19H16Cl4O4/c20-12-6-13(21)9-16(8-12)26-18(24)4-2-1-3-5-19(25)27-17-10-14(22)7-15(23)11-17/h6-11H,1-5H2
InChIKey AJYOWKUFSSPVFF-UHFFFAOYSA-N
Mol Weight 450.1 g/mol
Molecular Formula C19H16Cl4O4
Exact Mass 447.98027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RL6plvF2bM
Name Pimelic acid, di(3,5-dichlorophenyl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16Cl4O4
InChI InChI=1S/C19H16Cl4O4/c20-12-6-13(21)9-16(8-12)26-18(24)4-2-1-3-5-19(25)27-17-10-14(22)7-15(23)11-17/h6-11H,1-5H2
InChIKey AJYOWKUFSSPVFF-UHFFFAOYSA-N
Molecular Weight 450.145 g/mol
SMILES C(CCCCCC(Oc1cc(cc(c1)Cl)Cl)=O)(Oc1cc(cc(c1)Cl)Cl)=O
SPLASH splash10-00p3-9840000000-883ed78c3c278517d79e
Source of Spectrum TIPS-2022-653-0
Wiley ID 1822170