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Di-n-nonyl Phthalate-3,4,5,6-d4

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For Research Use Only | Not For Clinical Use
CATAPS1202865437
CAS1202865-43-7
Structure
SynonymsDinonyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate, Phthalic acid, bis-n-nonyl ester D4, Phthalic Acid Di-n-nonyl Ester (3,4,5,6)-D4
IUPAC Namedinonyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate
Molecular Weight422.63
Molecular FormulaC262H4H38O4
Canonical SMILES[2H]c1c([2H])c([2H])c(C(=O)OCCCCCCCCC)c(C(=O)OCCCCCCCCC)c1[2H]
InChIInChI=1S/C26H42O4/c1-3-5-7-9-11-13-17-21-29-25(27)23-19-15-16-20-24(23)26(28)30-22-18-14-12-10-8-6-4-2/h15-16,19-20H,3-14,17-18,21-22H2,1-2H3/i15D,16D,19D,20D
Accurate Mass422.3334
FormatNeat
SubcategoryPhthalates, Stable isotope labelled compounds
TypeStable Isotope Labelled
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