TRIBEHENIN(18641-57-1) 1H NMR
Product NameTRIBEHENIN
CAS18641-57-1
Molecular FormulaC69H134O6
Molecular Weight1059.8
InChIInChI=1S/C69H134O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h66H,4-65H2,1-3H3
InChIKey DMBUODUULYCPAK-UHFFFAOYSA-N
SmilesC(OC(=O)CCCCCCCCCCCCCCCCCCCCC)C(OC(=O)CCCCCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCCCCCC
400 MHz in CDCl3
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1H NMR 399.65 MHz C69 H134 O6 0.029 g : 0.5 ml CDCl3 1,2,3-propanetriyl tridocosanoate 
Assign. Shift(ppm)
A 5.255 B *1 4.290 C *1 4.145 D 2.302 E 1.60 F 1.29 G 1.26 J 0.879
Hz ppm Int.927.00 2.320 24 921.75 2.307 26 919.68 2.302 41 911.99 2.282 28 527.83 1.321 20 513.31 1.285 77 503.17 1.260 1000 490.36 1.227 30 358.52 0.898 35 351.81 0.881 121 344.85 0.863 44
in CDCl3
KBr disc
nujol mull
