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1,3,5-benzenetricarboxylic acid, tris(decyl) ester
SpectraBase Compound ID Cqkd9D4HGMJ
InChI InChI=1S/C39H66O6/c1-4-7-10-13-16-19-22-25-28-43-37(40)34-31-35(38(41)44-29-26-23-20-17-14-11-8-5-2)33-36(32-34)39(42)45-30-27-24-21-18-15-12-9-6-3/h31-33H,4-30H2,1-3H3
InChIKey RULJLCRLHSZAGP-UHFFFAOYSA-N
Mol Weight 631.0 g/mol
Molecular Formula C39H66O6
Exact Mass 630.48594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HkwALPvk7T
Name 1,3,5-benzenetricarboxylic acid, tris(decyl) ester
Alternate Name(s) Tris(decyl) benzene-1,3,5-tricarboxylate Tris-decyl benzene-1,3,5-tricarboxylate
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Formula C39H66O6
InChI InChI=1S/C39H66O6/c1-4-7-10-13-16-19-22-25-28-43-37(40)34-31-35(38(41)44-29-26-23-20-17-14-11-8-5-2)33-36(32-34)39(42)45-30-27-24-21-18-15-12-9-6-3/h31-33H,4-30H2,1-3H3
InChIKey RULJLCRLHSZAGP-UHFFFAOYSA-N
Molecular Weight 630.951 g/mol
SMILES CCCCCCCCCCOC(=O)c1cc(cc(c1)C(=O)OCCCCCCCCCC)C(=O)OCCCCCCCCCC
SPLASH splash10-059x-9202100000-1c1f55b7f45d1b3632f5
Source of Spectrum JX-2015-4-1355
Wiley ID 1726743