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Pimelic acid, 2,6-dichlorobenzyl methyl ester
SpectraBase Compound ID DLUOUIehYHB
InChI InChI=1S/C15H18Cl2O4/c1-20-14(18)8-3-2-4-9-15(19)21-10-11-12(16)6-5-7-13(11)17/h5-7H,2-4,8-10H2,1H3
InChIKey ZSKVFAWDBKLSAZ-UHFFFAOYSA-N
Mol Weight 333.21 g/mol
Molecular Formula C15H18Cl2O4
Exact Mass 332.058214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CuiFXRpJ9Uo
Name Pimelic acid, 2,6-dichlorobenzyl methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18Cl2O4
InChI InChI=1S/C15H18Cl2O4/c1-20-14(18)8-3-2-4-9-15(19)21-10-11-12(16)6-5-7-13(11)17/h5-7H,2-4,8-10H2,1H3
InChIKey ZSKVFAWDBKLSAZ-UHFFFAOYSA-N
Molecular Weight 333.211 g/mol
SMILES C(CCCCCC(OCc1c(cccc1Cl)Cl)=O)(OC)=O
SPLASH splash10-0a4i-5900000000-cb97001b1a63a94cdba3
Source of Spectrum TIPS-2022-733-0
Wiley ID 1822250