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2-[(Dodecanoyloxy)methyl]-2-hydroxy-4-[(p-nitrophenyl)oxy]-butyl dodecanoate
SpectraBase Compound ID GpBXp3VQPj2
InChI InChI=1S/C35H59NO8/c1-3-5-7-9-11-13-15-17-19-21-33(37)43-29-35(39,27-28-42-32-25-23-31(24-26-32)36(40)41)30-44-34(38)22-20-18-16-14-12-10-8-6-4-2/h23-26,39H,3-22,27-30H2,1-2H3
InChIKey MKDHSZQNBNRVNM-UHFFFAOYSA-N
Mol Weight 621.9 g/mol
Molecular Formula C35H59NO8
Exact Mass 621.424068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3TfxKjKkoy
Name 2-[(Dodecanoyloxy)methyl]-2-hydroxy-4-[(p-nitrophenyl)oxy]-butyl dodecanoate
Alternate Name(s) 2-[(dodecanoyloxy)methyl]-2-hydroxy-4-(4-nitrophenoxy)butyl laurate Dodecanoic acid [2-hydroxy-4-(4-nitrophenoxy)-2-(1-oxododecoxymethyl)butyl] ester [2-(dodecanoyloxymethyl)-2-hydroxy-4-(4-nitrophenoxy)butyl] dodecanoate [2-(dodecanoyloxymethyl)-4-(4-nitrophenoxy)-2-oxidanyl-butyl] dodecanoate
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Formula C35H59NO8
InChI InChI=1S/C35H59NO8/c1-3-5-7-9-11-13-15-17-19-21-33(37)43-29-35(39,27-28-42-32-25-23-31(24-26-32)36(40)41)30-44-34(38)22-20-18-16-14-12-10-8-6-4-2/h23-26,39H,3-22,27-30H2,1-2H3
InChIKey MKDHSZQNBNRVNM-UHFFFAOYSA-N
Molecular Weight 621.856 g/mol
SMILES OC(CCOc1ccc(N(=O)=O)cc1)(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC
SPLASH splash10-001i-9400005000-32457634bf6ad9349829
Source of Spectrum H-86-2469-21
Wiley ID 1525580