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4H-pyran-2-acetic acid, 6-amino-5-cyano-3-(ethoxycarbonyl)-4-(2-ethoxyphenyl)-, ethyl ester
SpectraBase Compound ID 3QBN5ReJRfN
InChI InChI=1S/C21H24N2O6/c1-4-26-15-10-8-7-9-13(15)18-14(12-22)20(23)29-16(11-17(24)27-5-2)19(18)21(25)28-6-3/h7-10,18H,4-6,11,23H2,1-3H3
InChIKey YOYNICUGTKAQGN-UHFFFAOYSA-N
Mol Weight 400.43 g/mol
Molecular Formula C21H24N2O6
Exact Mass 400.163436 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8eU7Y5ASsii
Name 4H-pyran-2-acetic acid, 6-amino-5-cyano-3-(ethoxycarbonyl)-4-(2-ethoxyphenyl)-, 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 400.163436495 u
Formula C21H24N2O6
InChI InChI=1S/C21H24N2O6/c1-4-26-15-10-8-7-9-13(15)18-14(12-22)20(23)29-16(11-17(24)27-5-2)19(18)21(25)28-6-3/h7-10,18H,4-6,11,23H2,1-3H3
InChIKey YOYNICUGTKAQGN-UHFFFAOYSA-N
Molecular Weight 400.431 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_2136
Solvent DMSO-d6
Source Vendor ID: NMR/13268341