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2,6-Pyridinedicarboxylic acid, 3-methylbenzyl nonyl ester
SpectraBase Compound ID LljwvwaNAA7
InChI InChI=1S/C24H31NO4/c1-3-4-5-6-7-8-9-16-28-23(26)21-14-11-15-22(25-21)24(27)29-18-20-13-10-12-19(2)17-20/h10-15,17H,3-9,16,18H2,1-2H3
InChIKey GXQUCAXUAVOJQV-UHFFFAOYSA-N
Mol Weight 397.52 g/mol
Molecular Formula C24H31NO4
Exact Mass 397.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hn55svAyy3q
Name 2,6-Pyridinedicarboxylic acid, 3-methylbenzyl nonyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO4
InChI InChI=1S/C24H31NO4/c1-3-4-5-6-7-8-9-16-28-23(26)21-14-11-15-22(25-21)24(27)29-18-20-13-10-12-19(2)17-20/h10-15,17H,3-9,16,18H2,1-2H3
InChIKey GXQUCAXUAVOJQV-UHFFFAOYSA-N
Molecular Weight 397.515 g/mol
SMILES C(OC(c1nc(ccc1)C(OCc1cc(ccc1)C)=O)=O)CCCCCCCC
SPLASH splash10-0ab9-4910000000-4d8fc838b81b4190db27
Source of Spectrum TIPS-2023-950-0
Wiley ID 1885656