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2,6-Pyridinedicarboxylic acid, 3,4,5-trifluorobenzyl butyl ester
SpectraBase Compound ID 8ql6sKRzazU
InChI InChI=1S/C18H16F3NO4/c1-2-3-7-25-17(23)14-5-4-6-15(22-14)18(24)26-10-11-8-12(19)16(21)13(20)9-11/h4-6,8-9H,2-3,7,10H2,1H3
InChIKey YEPDXJQLQDSDGH-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 EvtzZNPI4w0
Name 2,6-Pyridinedicarboxylic acid, 3,4,5-trifluorobenzyl butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16F3NO4
InChI InChI=1S/C18H16F3NO4/c1-2-3-7-25-17(23)14-5-4-6-15(22-14)18(24)26-10-11-8-12(19)16(21)13(20)9-11/h4-6,8-9H,2-3,7,10H2,1H3
InChIKey YEPDXJQLQDSDGH-UHFFFAOYSA-N
Molecular Weight 367.324 g/mol
SMILES C(OC(c1nc(ccc1)C(OCc1cc(c(c(c1)F)F)F)=O)=O)CCC
SPLASH splash10-004j-2900000000-5812eaf9cf8dc9358a54
Source of Spectrum TIPS-2023-897-0
Wiley ID 1885603