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2,3-Di(tetradecanoyloxy)propyl pyridine-3-carboxylate
SpectraBase Compound ID KeI8zWOmbAD
InChI InChI=1S/C37H63NO6/c1-3-5-7-9-11-13-15-17-19-21-23-27-35(39)42-31-34(32-43-37(41)33-26-25-29-38-30-33)44-36(40)28-24-22-20-18-16-14-12-10-8-6-4-2/h25-26,29-30,34H,3-24,27-28,31-32H2,1-2H3
InChIKey QMLISIQVXCGOSQ-UHFFFAOYSA-N
Mol Weight 617.9 g/mol
Molecular Formula C37H63NO6
Exact Mass 617.465539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmUvPO4ksG2
Name 2,3-Di(tetradecanoyloxy)propyl pyridine-3-carboxylate
Alternate Name(s) 3-Pyridinecarboxylic acid 2,3-bis(1-oxotetradecoxy)propyl ester Nicotinic acid 2,3-di(tetradecanoyloxy)propyl ester
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Formula C37H63NO6
InChI InChI=1S/C37H63NO6/c1-3-5-7-9-11-13-15-17-19-21-23-27-35(39)42-31-34(32-43-37(41)33-26-25-29-38-30-33)44-36(40)28-24-22-20-18-16-14-12-10-8-6-4-2/h25-26,29-30,34H,3-24,27-28,31-32H2,1-2H3
InChIKey QMLISIQVXCGOSQ-UHFFFAOYSA-N
Molecular Weight 617.912 g/mol
SMILES C(c1cnccc1)(OCC(OC(=O)CCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCC)=O
SPLASH splash10-00di-0900200000-b811cee30eb023f4fc22
Source of Spectrum O-29-253-0
Wiley ID 1411372