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acetic acid, [[3,5-dicyano-4-(2-ethoxyphenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, methyl ester
SpectraBase Compound ID EwHiou4oSdZ
InChI InChI=1S/C18H17N3O4S/c1-3-25-14-7-5-4-6-11(14)16-12(8-19)17(23)21-18(13(16)9-20)26-10-15(22)24-2/h4-7,12,16H,3,10H2,1-2H3,(H,21,23)
InChIKey XVCBYHOUYXCIKS-UHFFFAOYSA-N
Mol Weight 371.41 g/mol
Molecular Formula C18H17N3O4S
Exact Mass 371.093977 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 81f3pUPzCwH
Name acetic acid, [[3,5-dicyano-4-(2-ethoxyphenyl)-1,4,5,6-tetrahydro-6-oxo-2-pyridinyl]thio]-, methyl 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 371.093977209 u
Formula C18H17N3O4S
InChI InChI=1S/C18H17N3O4S/c1-3-25-14-7-5-4-6-11(14)16-12(8-19)17(23)21-18(13(16)9-20)26-10-15(22)24-2/h4-7,12,16H,3,10H2,1-2H3,(H,21,23)
InChIKey XVCBYHOUYXCIKS-UHFFFAOYSA-N
Molecular Weight 371.411 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9030
Solvent DMSO-d6
Source Vendor ID: NMR/9253182; Lab Info: KR; Lab Number: KR-0000034