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1,3-Dinicotinoyl-2-tetradecanoylglycerol
SpectraBase Compound ID 4eYLznccBQl
InChI InChI=1S/C29H40N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-17-27(32)37-26(22-35-28(33)24-15-13-18-30-20-24)23-36-29(34)25-16-14-19-31-21-25/h13-16,18-21,26H,2-12,17,22-23H2,1H3
InChIKey ZFSWBIYVRRHPER-UHFFFAOYSA-N
Mol Weight 512.6 g/mol
Molecular Formula C29H40N2O6
Exact Mass 512.288637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9oYH1Ay2D4W
Name 1,3-Dinicotinoyl-2-tetradecanoylglycerol
Alternate Name(s) 3-[(3-pyridinylcarbonyl)oxy]-2-(tetradecanoyloxy)propyl nicotinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H40N2O6
InChI InChI=1S/C29H40N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-17-27(32)37-26(22-35-28(33)24-15-13-18-30-20-24)23-36-29(34)25-16-14-19-31-21-25/h13-16,18-21,26H,2-12,17,22-23H2,1H3
InChIKey ZFSWBIYVRRHPER-UHFFFAOYSA-N
Molecular Weight 512.647 g/mol
SMILES C(c1cnccc1)(OCC(OC(=O)CCCCCCCCCCCCC)COC(c1cnccc1)=O)=O
SPLASH splash10-0c00-0902000000-64e8eb4a0d6095345bce
Source of Spectrum O-29-253-0
Wiley ID 1400831