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4-morpholinecarboxylic acid, 4-(2-amino-3-cyano-5,6,7,8-tetrahydro-5-oxo-4H-1-benzopyran-4-yl)-2,6-dimethoxyphenyl ester
SpectraBase Compound ID Cw6z3JK29IZ
InChI InChI=1S/C23H25N3O7/c1-29-17-10-13(11-18(30-2)21(17)33-23(28)26-6-8-31-9-7-26)19-14(12-24)22(25)32-16-5-3-4-15(27)20(16)19/h10-11,19H,3-9,25H2,1-2H3
InChIKey WIKGFSQXRKPATH-UHFFFAOYSA-N
Mol Weight 455.47 g/mol
Molecular Formula C23H25N3O7
Exact Mass 455.16925 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 91L4ULV5QEV
Name 4-morpholinecarboxylic acid, 4-(2-amino-3-cyano-5,6,7,8-tetrahydro-5-oxo-4H-1-benzopyran-4-yl)-2,6-dimethoxyphenyl 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 455.169250150 u
Formula C23H25N3O7
InChI InChI=1S/C23H25N3O7/c1-29-17-10-13(11-18(30-2)21(17)33-23(28)26-6-8-31-9-7-26)19-14(12-24)22(25)32-16-5-3-4-15(27)20(16)19/h10-11,19H,3-9,25H2,1-2H3
InChIKey WIKGFSQXRKPATH-UHFFFAOYSA-N
Molecular Weight 455.467 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4413
Solvent DMSO-d6
Source Vendor ID: NMR/9301932; Lab Info: VUR; Lab Number: VUR-0000704