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Pimelic acid, 2,2-dichloroethyl dodecyl ester
SpectraBase Compound ID DDBZ3r5Ej4f
InChI InChI=1S/C21H38Cl2O4/c1-2-3-4-5-6-7-8-9-10-14-17-26-20(24)15-12-11-13-16-21(25)27-18-19(22)23/h19H,2-18H2,1H3
InChIKey GXFYEKGBLCSLLA-UHFFFAOYSA-N
Mol Weight 425.4 g/mol
Molecular Formula C21H38Cl2O4
Exact Mass 424.214715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KQxzYo29ru
Name Pimelic acid, 2,2-dichloroethyl dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38Cl2O4
InChI InChI=1S/C21H38Cl2O4/c1-2-3-4-5-6-7-8-9-10-14-17-26-20(24)15-12-11-13-16-21(25)27-18-19(22)23/h19H,2-18H2,1H3
InChIKey GXFYEKGBLCSLLA-UHFFFAOYSA-N
Molecular Weight 425.437 g/mol
SMILES C(CCCCCC(OCC(Cl)Cl)=O)(OCCCCCCCCCCCC)=O
SPLASH splash10-0006-9520000000-2283b547fa81107aee63
Source of Spectrum TIPS-2022-902-0
Wiley ID 1822419