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2,6-Pyridinedicarboxylic acid, 4-trifluoromethylbenzyl propyl ester
SpectraBase Compound ID 8dzZTEeiZlP
InChI InChI=1S/C18H16F3NO4/c1-2-10-25-16(23)14-4-3-5-15(22-14)17(24)26-11-12-6-8-13(9-7-12)18(19,20)21/h3-9H,2,10-11H2,1H3
InChIKey ZKMHQDAPYAFBNL-UHFFFAOYSA-N
Mol Weight 367.32 g/mol
Molecular Formula C18H16F3NO4
Exact Mass 367.103142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8exQXPoHzm8
Name 2,6-Pyridinedicarboxylic acid, 4-trifluoromethylbenzyl propyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16F3NO4
InChI InChI=1S/C18H16F3NO4/c1-2-10-25-16(23)14-4-3-5-15(22-14)17(24)26-11-12-6-8-13(9-7-12)18(19,20)21/h3-9H,2,10-11H2,1H3
InChIKey ZKMHQDAPYAFBNL-UHFFFAOYSA-N
Molecular Weight 367.324 g/mol
SMILES C(OC(c1nc(ccc1)C(OCc1ccc(cc1)C(F)(F)F)=O)=O)CC
SPLASH splash10-066r-1900000000-2d291936f4b4c9d27329
Source of Spectrum TIPS-2023-969-0
Wiley ID 1885675