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Reference substances

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IUPAC name:
Fatty acids, C16-18 and C18-unsatd., mixed esters with adipic acid and trimethylolpropane

Inventory

EC number:
292-832-8
EC name:
Fatty acids, C16-18 and C18-unsatd., mixed esters with adipic acid and trimethylolpropane
CAS number:
91001-61-5
CAS number:
91001-61-5

Synonyms

Molecular and structural information

Molecular formula:
Examples of molecular formules that represents this substance: C54H104O6; C60H110O6; C60H110O6
Molecular weight:
>= 518 - <= 933
SMILES notation:
Examples of smiles notation of C60H110O6:
C(CCCCCCC\C=C/CCCCCCCC)(=O)OCC(CC)(COC(CCCCCCC\C=C/CCCCCCCC)=O)COC(CCCCCCC\C=C/CCCCCCCC)=O
InChl:
Examples of InChI notation of C60H110O6:
InChI=1S/C60H110O6/c1-5-9-12-15-18-21-24-27-30-33-36-39-42-45-48-51-57(61)64-54-60(8-4,55-65-58(62)52-49-46-43-40-37-34-31-28-25-22-19-16-13-10-6-2)56-66-59(63)53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-7-3/h27-32H,5-26,33-56H2,1-4H3/b30-27-,31-28-,32-29-
Structural formula:
Chemical structure

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