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3-nicotinoyl-1,2-didodecanoyl-rac-glycerol
SpectraBase Compound ID Fki0Ss1UQlw
InChI InChI=1S/C33H55NO6/c1-3-5-7-9-11-13-15-17-19-23-31(35)38-27-30(28-39-33(37)29-22-21-25-34-26-29)40-32(36)24-20-18-16-14-12-10-8-6-4-2/h21-22,25-26,30H,3-20,23-24,27-28H2,1-2H3
InChIKey AWWHVLUWWORKFN-UHFFFAOYSA-N
Mol Weight 561.8 g/mol
Molecular Formula C33H55NO6
Exact Mass 561.402938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dt0ubHPgVg
Name 3-nicotinoyl-1,2-didodecanoyl-rac-glycerol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H55NO6
InChI InChI=1S/C33H55NO6/c1-3-5-7-9-11-13-15-17-19-23-31(35)38-27-30(28-39-33(37)29-22-21-25-34-26-29)40-32(36)24-20-18-16-14-12-10-8-6-4-2/h21-22,25-26,30H,3-20,23-24,27-28H2,1-2H3
InChIKey AWWHVLUWWORKFN-UHFFFAOYSA-N
Molecular Weight 561.804 g/mol
SMILES C(c1cnccc1)(OCC(OC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC)=O
SPLASH splash10-00di-0900300000-32619e0b38bbb9517c5c
Source of Spectrum O-29-253-0
Synonyms 2,3-bis(dodecanoyloxy)propyl nicotinate
Wiley ID 1406839