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4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)phenyl benzoate

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4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)phenyl benzoate
SpectraBase Compound ID 80uFpfeTin8
InChI InChI=1S/C23H18N2O4/c24-13-17-20(21-18(26)7-4-8-19(21)29-22(17)25)14-9-11-16(12-10-14)28-23(27)15-5-2-1-3-6-15/h1-3,5-6,9-12,20H,4,7-8,25H2
InChIKey OYUBNXMWRQLCNI-UHFFFAOYSA-N
Mol Weight 386.41 g/mol
Molecular Formula C23H18N2O4
Exact Mass 386.126657 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BAdSJj3FHYr
Name 4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)phenyl benzoate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H18N2O4/c24-13-17-20(21-18(26)7-4-8-19(21)29-22(17)25)14-9-11-16(12-10-14)28-23(27)15-5-2-1-3-6-15/h1-3,5-6,9-12,20H,4,7-8,25H2
InChIKey OYUBNXMWRQLCNI-UHFFFAOYSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_2748
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/9251064; Labnumber: L-19,Rozhkov