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Pimelic acid, 2,2-dichloroethyl undecyl ester
SpectraBase Compound ID B2JHhbdcZia
InChI InChI=1S/C20H36Cl2O4/c1-2-3-4-5-6-7-8-9-13-16-25-19(23)14-11-10-12-15-20(24)26-17-18(21)22/h18H,2-17H2,1H3
InChIKey MYQLYUDSQUVHEC-UHFFFAOYSA-N
Mol Weight 411.4 g/mol
Molecular Formula C20H36Cl2O4
Exact Mass 410.199065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Gb5emDiZEq
Name Pimelic acid, 2,2-dichloroethyl undecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36Cl2O4
InChI InChI=1S/C20H36Cl2O4/c1-2-3-4-5-6-7-8-9-13-16-25-19(23)14-11-10-12-15-20(24)26-17-18(21)22/h18H,2-17H2,1H3
InChIKey MYQLYUDSQUVHEC-UHFFFAOYSA-N
Molecular Weight 411.410 g/mol
SMILES C(CCCCCC(OCC(Cl)Cl)=O)(OCCCCCCCCCCC)=O
SPLASH splash10-0006-9520000000-57ce0b48add9a5cc07a9
Source of Spectrum TIPS-2022-901-0
Wiley ID 1822418