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benzoic acid, 2-[[[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-yl]carbonyl]amino]-, methyl ester
SpectraBase Compound ID 1C6NJwNe2ta
InChI InChI=1S/C25H19NO5/c1-15-11-13-16(14-12-15)21-17-7-3-4-8-18(17)25(29)31-22(21)23(27)26-20-10-6-5-9-19(20)24(28)30-2/h3-14H,1-2H3,(H,26,27)
InChIKey JDMXEXKDLHPHNK-UHFFFAOYSA-N
Mol Weight 413.43 g/mol
Molecular Formula C25H19NO5
Exact Mass 413.126323 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2hps8njhEMh
Name benzoic acid, 2-[[[4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-yl]carbonyl]amino]-, 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 413.126322711 u
Formula C25H19NO5
InChI InChI=1S/C25H19NO5/c1-15-11-13-16(14-12-15)21-17-7-3-4-8-18(17)25(29)31-22(21)23(27)26-20-10-6-5-9-19(20)24(28)30-2/h3-14H,1-2H3,(H,26,27)
InChIKey JDMXEXKDLHPHNK-UHFFFAOYSA-N
Molecular Weight 413.429 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_395
Solvent DMSO-d6
Source Vendor ID: NMR/13238757