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Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
3-[(2-ethylhexanoyl)oxy]-2-{[(2-ethylhexanoyl)oxy]methyl}-2-(hydroxymethyl)propyl 2-ethylhexanoate

Molecular and structural information

Molecular formula:
C29H54O7
Molecular weight:
514.73
SMILES notation:
O=C(OCC(COC(=O)C(CC)CCCC)(CO)COC(=O)C(CC)CCCC)C(CC)CCCC
InChl:
InChI=1/C29H54O7/c1-7-13-16-23(10-4)26(31)34-20-29(19-30,21-35-27(32)24(11-5)17-14-8-2)22-36-28(33)25(12-6)18-15-9-3/h23-25,30H,7-22H2,1-6H3
Structural formula:
Chemical structure