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2,6-Pyridinedicarboxylic acid, 4,4-dimethylpent-2-yl heptyl ester

View entire compound with spectra: 1 MS (GC)

2,6-Pyridinedicarboxylic acid, 4,4-dimethylpent-2-yl heptyl ester
SpectraBase Compound ID FvWN4vCdtac
InChI InChI=1S/C21H33NO4/c1-6-7-8-9-10-14-25-19(23)17-12-11-13-18(22-17)20(24)26-16(2)15-21(3,4)5/h11-13,16H,6-10,14-15H2,1-5H3
InChIKey YQXGDAFEJDKWBD-UHFFFAOYSA-N
Mol Weight 363.5 g/mol
Molecular Formula C21H33NO4
Exact Mass 363.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fh3p5QLuBIJ
Name 2,6-Pyridinedicarboxylic acid, 4,4-dimethylpent-2-yl heptyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H33NO4
InChI InChI=1S/C21H33NO4/c1-6-7-8-9-10-14-25-19(23)17-12-11-13-18(22-17)20(24)26-16(2)15-21(3,4)5/h11-13,16H,6-10,14-15H2,1-5H3
InChIKey YQXGDAFEJDKWBD-UHFFFAOYSA-N
Molecular Weight 363.498 g/mol
SMILES c1(nc(ccc1)C(OCCCCCCC)=O)C(OC(CC(C)(C)C)C)=O
SPLASH splash10-066r-8950000000-7868cd16437922bdab43
Source of Spectrum TIPS-2023-1029-0
Wiley ID 1885735