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2,6-Pyridinedicarboxylic acid, 4-trifluoromethylbenzyl pentadecyl ester
SpectraBase Compound ID 2NbSeW16V2W
InChI InChI=1S/C30H40F3NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22-37-28(35)26-16-15-17-27(34-26)29(36)38-23-24-18-20-25(21-19-24)30(31,32)33/h15-21H,2-14,22-23H2,1H3
InChIKey PKLMGSABURVPDX-UHFFFAOYSA-N
Mol Weight 535.6 g/mol
Molecular Formula C30H40F3NO4
Exact Mass 535.290943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KJ4BW4Dvq2
Name 2,6-Pyridinedicarboxylic acid, 4-trifluoromethylbenzyl pentadecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40F3NO4
InChI InChI=1S/C30H40F3NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22-37-28(35)26-16-15-17-27(34-26)29(36)38-23-24-18-20-25(21-19-24)30(31,32)33/h15-21H,2-14,22-23H2,1H3
InChIKey PKLMGSABURVPDX-UHFFFAOYSA-N
Molecular Weight 535.648 g/mol
SMILES C(OC(c1nc(ccc1)C(OCc1ccc(cc1)C(F)(F)F)=O)=O)CCCCCCCCCCCCCC
SPLASH splash10-0a4i-5923000000-ed6121b2d6b207a817e8
Source of Spectrum TIPS-2023-977-0
Wiley ID 1885683