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1,2-Benzenedicarboxylic acid, 2-(2-methoxy-2-oxoethyl)hexyl methyl ester
SpectraBase Compound ID LncWhO2vSEV
InChI InChI=1S/C18H24O6/c1-4-5-8-13(11-16(19)22-2)12-24-18(21)15-10-7-6-9-14(15)17(20)23-3/h6-7,9-10,13H,4-5,8,11-12H2,1-3H3
InChIKey MQDZUKNHDIVRIV-UHFFFAOYSA-N
Mol Weight 336.38 g/mol
Molecular Formula C18H24O6
Exact Mass 336.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QoMfiRrfbp
Name 1,2-Benzenedicarboxylic acid, 2-(2-methoxy-2-oxoethyl)hexyl methyl ester
CAS Registry Number 76644-65-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O6
InChI InChI=1S/C18H24O6/c1-4-5-8-13(11-16(19)22-2)12-24-18(21)15-10-7-6-9-14(15)17(20)23-3/h6-7,9-10,13H,4-5,8,11-12H2,1-3H3
InChIKey MQDZUKNHDIVRIV-UHFFFAOYSA-N
Molecular Weight 336.384 g/mol
SMILES c1(c(C(=O)OC)cccc1)C(OCC(CC(=O)OC)CCCC)=O
SPLASH splash10-03di-0900000000-ae403bbb962ff95caabe
Source of Spectrum KO-7-243-1
Synonyms benzene-1,2-dicarboxylic acid O2-[2-(2-methoxy-2-oxoethyl)hexyl] ester O1-methyl ester 2-O-[2-(2-methoxy-2-oxoethyl)hexyl] 1-O-methyl benzene-1,2-dicarboxylate O2-[2-(2-methoxy-2-oxo-ethyl)hexyl] O1-methyl benzene-1,2-dicarboxylate O2-[2-(2-methoxy-2-oxidanylidene-ethyl)hexyl] O1-methyl benzene-1,2-dicarboxylate
Wiley ID 1332314