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3-pyridinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-4-[2-(1-methylethoxy)phenyl]-6-oxo-, phenylmethyl ester
SpectraBase Compound ID 8cs2sjeiZGr
InChI InChI=1S/C23H25NO4/c1-15(2)28-20-12-8-7-11-18(20)19-13-21(25)24-16(3)22(19)23(26)27-14-17-9-5-4-6-10-17/h4-12,15,19H,13-14H2,1-3H3,(H,24,25)
InChIKey AFWZYUVXWFBKMD-UHFFFAOYSA-N
Mol Weight 379.46 g/mol
Molecular Formula C23H25NO4
Exact Mass 379.178358 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID I0Ys8hxMAhh
Name 3-pyridinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-4-[2-(1-methylethoxy)phenyl]-6-oxo-, phenylmethyl 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 379.178358285 u
Formula C23H25NO4
InChI InChI=1S/C23H25NO4/c1-15(2)28-20-12-8-7-11-18(20)19-13-21(25)24-16(3)22(19)23(26)27-14-17-9-5-4-6-10-17/h4-12,15,19H,13-14H2,1-3H3,(H,24,25)
InChIKey AFWZYUVXWFBKMD-UHFFFAOYSA-N
Molecular Weight 379.456 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7640
Solvent DMSO-d6
Source Vendor ID: NMR/9313457; Lab Info: SAS; Lab Number: SAS-tst3190
Temperature 23.85 °C