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3-(1,3-benzodioxol-5-yl)-N-[1-(2,4-dimethylphenyl)ethyl]-6-methylisoxazolo[5,4-b]pyridine-4-carboxamide
SpectraBase Compound ID 9ybagOYIqGz
InChI InChI=1S/C25H23N3O4/c1-13-5-7-18(14(2)9-13)16(4)27-24(29)19-10-15(3)26-25-22(19)23(28-32-25)17-6-8-20-21(11-17)31-12-30-20/h5-11,16H,12H2,1-4H3,(H,27,29)
InChIKey FIGIVEWJFZCWBO-UHFFFAOYSA-N
Mol Weight 429.48 g/mol
Molecular Formula C25H23N3O4
Exact Mass 429.168856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID iEblic5Pxn
Name 3-(1,3-benzodioxol-5-yl)-N-[1-(2,4-dimethylphenyl)ethyl]-6-methylisoxazolo[5,4-b]pyridine-4-carboxamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H23N3O4/c1-13-5-7-18(14(2)9-13)16(4)27-24(29)19-10-15(3)26-25-22(19)23(28-32-25)17-6-8-20-21(11-17)31-12-30-20/h5-11,16H,12H2,1-4H3,(H,27,29)
InChIKey FIGIVEWJFZCWBO-UHFFFAOYSA-N
NMR Offset 17.9107
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_33768
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: 1996502; SBI_ID: SBI-033772
Temperature 303 °C