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1,3-benzodioxole-5-carboxylic acid, 6-[[(1-oxo-4-phenyl-1H-2-benzopyran-3-yl)carbonyl]amino]-, methyl ester
SpectraBase Compound ID IZwgXxyokPY
InChI InChI=1S/C25H17NO7/c1-30-24(28)17-11-19-20(32-13-31-19)12-18(17)26-23(27)22-21(14-7-3-2-4-8-14)15-9-5-6-10-16(15)25(29)33-22/h2-12H,13H2,1H3,(H,26,27)
InChIKey ILTJZFAARFATAO-UHFFFAOYSA-N
Mol Weight 443.41 g/mol
Molecular Formula C25H17NO7
Exact Mass 443.100502 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bm6y0jpkZ0J
Name 1,3-benzodioxole-5-carboxylic acid, 6-[[(1-oxo-4-phenyl-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 443.100501884 u
Formula C25H17NO7
InChI InChI=1S/C25H17NO7/c1-30-24(28)17-11-19-20(32-13-31-19)12-18(17)26-23(27)22-21(14-7-3-2-4-8-14)15-9-5-6-10-16(15)25(29)33-22/h2-12H,13H2,1H3,(H,26,27)
InChIKey ILTJZFAARFATAO-UHFFFAOYSA-N
Molecular Weight 443.411 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_6561
Solvent DMSO-d6
Source Vendor ID: NMR/13289952