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3,5-pyridinedicarboxylic acid, 1,4-dihydro-1-methyl-4-[4-(trifluoromethyl)phenyl]-, dimethyl ester
SpectraBase Compound ID L2Orrkucjz6
InChI InChI=1S/C17H16F3NO4/c1-21-8-12(15(22)24-2)14(13(9-21)16(23)25-3)10-4-6-11(7-5-10)17(18,19)20/h4-9,14H,1-3H3
InChIKey IVTYUXFCNQFJDN-UHFFFAOYSA-N
Mol Weight 355.31 g/mol
Molecular Formula C17H16F3NO4
Exact Mass 355.103142 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F2cik18ixrb
Name 3,5-pyridinedicarboxylic acid, 1,4-dihydro-1-methyl-4-[4-(trifluoromethyl)phenyl]-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.103142484 u
Formula C17H16F3NO4
InChI InChI=1S/C17H16F3NO4/c1-21-8-12(15(22)24-2)14(13(9-21)16(23)25-3)10-4-6-11(7-5-10)17(18,19)20/h4-9,14H,1-3H3
InChIKey IVTYUXFCNQFJDN-UHFFFAOYSA-N
Molecular Weight 355.313 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11667
Solvent DMSO-d6
Source Vendor ID: NMR/10271289; Lab Info: SAS; Lab Number: SAS-tst4043
Temperature 29.85 °C