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Adipic acid (4,5-Dimethoxy-2-nitrobenzyl) ester Methyl ester
SpectraBase Compound ID 36bTEjq8Y9n
InChI InChI=1S/C16H21NO8/c1-22-13-8-11(12(17(20)21)9-14(13)23-2)10-25-16(19)7-5-4-6-15(18)24-3/h8-9H,4-7,10H2,1-3H3
InChIKey PEDKNASXHZLFBQ-UHFFFAOYSA-N
Mol Weight 355.34 g/mol
Molecular Formula C16H21NO8
Exact Mass 355.126717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxUKlIquxEF
Name Adipic acid (4,5-Dimethoxy-2-nitrobenzyl) ester Methyl ester
Alternate Name(s) 1-(4,5-dimethoxy-2-nitrobenzyl) 6-methyl hexanedioate Hexanedioic acid O6-[(4,5-dimethoxy-2-nitrophenyl)methyl] ester O1-methyl ester 6-O-[(4,5-dimethoxy-2-nitrophenyl)methyl] 1-O-methyl hexanedioate O6-[(4,5-dimethoxy-2-nitro-phenyl)methyl] O1-methyl hexanedioate
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Formula C16H21NO8
InChI InChI=1S/C16H21NO8/c1-22-13-8-11(12(17(20)21)9-14(13)23-2)10-25-16(19)7-5-4-6-15(18)24-3/h8-9H,4-7,10H2,1-3H3
InChIKey PEDKNASXHZLFBQ-UHFFFAOYSA-N
Molecular Weight 355.343 g/mol
SMILES c1(N(=O)=O)c(cc(c(c1)OC)OC)COC(=O)CCCCC(=O)OC
SPLASH splash10-0a4i-6900000000-f877c3663768c666b193
Source of Spectrum J-67-5576-19
Wiley ID 1570546