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

View entire compound with spectra: 1 MS (GC)

2,6-Pyridinedicarboxylic acid, 4,4-dimethylpent-2-yl octyl ester
SpectraBase Compound ID FpCUIPdsjlo
InChI InChI=1S/C22H35NO4/c1-6-7-8-9-10-11-15-26-20(24)18-13-12-14-19(23-18)21(25)27-17(2)16-22(3,4)5/h12-14,17H,6-11,15-16H2,1-5H3
InChIKey KHDSNWBKFDEWBL-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C22H35NO4
Exact Mass 377.256609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kt7CcwwD5j3
Name 2,6-Pyridinedicarboxylic acid, 4,4-dimethylpent-2-yl octyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H35NO4
InChI InChI=1S/C22H35NO4/c1-6-7-8-9-10-11-15-26-20(24)18-13-12-14-19(23-18)21(25)27-17(2)16-22(3,4)5/h12-14,17H,6-11,15-16H2,1-5H3
InChIKey KHDSNWBKFDEWBL-UHFFFAOYSA-N
Molecular Weight 377.525 g/mol
SMILES c1(nc(ccc1)C(OCCCCCCCC)=O)C(OC(CC(C)(C)C)C)=O
SPLASH splash10-067i-8950000000-d5c16fdbb510c1c77776
Source of Spectrum TIPS-2023-1030-0
Wiley ID 1885736