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1,6-naphthyridine-4-carboxylic acid, 3-cyano-6-ethyl-5,6,7,8-tetrahydro-2-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-, ethyl ester
SpectraBase Compound ID BynyVXbASLe
InChI InChI=1S/C23H26N4O4S/c1-4-27-11-10-19-18(13-27)21(23(29)31-5-2)17(12-24)22(26-19)32-14-20(28)25-15-6-8-16(30-3)9-7-15/h6-9H,4-5,10-11,13-14H2,1-3H3,(H,25,28)
InChIKey RDTMUNNWUHQQAT-UHFFFAOYSA-N
Mol Weight 454.55 g/mol
Molecular Formula C23H26N4O4S
Exact Mass 454.167477 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BqXdzLxUHud
Name 1,6-naphthyridine-4-carboxylic acid, 3-cyano-6-ethyl-5,6,7,8-tetrahydro-2-[[2-[(4-methoxyphenyl)amino]-2-oxoethyl]thio]-, ethyl 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 454.167476503 u
Formula C23H26N4O4S
InChI InChI=1S/C23H26N4O4S/c1-4-27-11-10-19-18(13-27)21(23(29)31-5-2)17(12-24)22(26-19)32-14-20(28)25-15-6-8-16(30-3)9-7-15/h6-9H,4-5,10-11,13-14H2,1-3H3,(H,25,28)
InChIKey RDTMUNNWUHQQAT-UHFFFAOYSA-N
Molecular Weight 454.545 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2120
Solvent DMSO-d6
Source Vendor ID: NMR/13268312