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2,6-Pyridinedicarboxylic acid, 5-methylhex-2-yl dodecyl ester
SpectraBase Compound ID KaVtfXeku12
InChI InChI=1S/C26H43NO4/c1-5-6-7-8-9-10-11-12-13-14-20-30-25(28)23-16-15-17-24(27-23)26(29)31-22(4)19-18-21(2)3/h15-17,21-22H,5-14,18-20H2,1-4H3
InChIKey CHEGKNCUQWHWJB-UHFFFAOYSA-N
Mol Weight 433.6 g/mol
Molecular Formula C26H43NO4
Exact Mass 433.319209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VMaYI8jtML
Name 2,6-Pyridinedicarboxylic acid, 5-methylhex-2-yl dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H43NO4
InChI InChI=1S/C26H43NO4/c1-5-6-7-8-9-10-11-12-13-14-20-30-25(28)23-16-15-17-24(27-23)26(29)31-22(4)19-18-21(2)3/h15-17,21-22H,5-14,18-20H2,1-4H3
InChIKey CHEGKNCUQWHWJB-UHFFFAOYSA-N
Molecular Weight 433.633 g/mol
SMILES C(OC(c1nc(ccc1)C(OC(CCC(C)C)C)=O)=O)CCCCCCCCCCC
SPLASH splash10-0avl-7922000000-cfa73b1dfc7597e8876b
Source of Spectrum TIPS-2023-934-0
Wiley ID 1885640