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N-(1-adamantyl)-3-(1,3-benzodioxol-5-yl)-6-methylisoxazolo[5,4-b]pyridine-4-carboxamide
SpectraBase Compound ID BFm2Rh6qMuC
InChI InChI=1S/C25H25N3O4/c1-13-4-18(23(29)27-25-9-14-5-15(10-25)7-16(6-14)11-25)21-22(28-32-24(21)26-13)17-2-3-19-20(8-17)31-12-30-19/h2-4,8,14-16H,5-7,9-12H2,1H3,(H,27,29)/t14-,15+,16-,25-
InChIKey SQJPLKIUAODTIE-JRVBSRRWSA-N
Mol Weight 431.49 g/mol
Molecular Formula C25H25N3O4
Exact Mass 431.184506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FIgGrRCJf2C
Name N-(1-adamantyl)-3-(1,3-benzodioxol-5-yl)-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/C25H25N3O4/c1-13-4-18(23(29)27-25-9-14-5-15(10-25)7-16(6-14)11-25)21-22(28-32-24(21)26-13)17-2-3-19-20(8-17)31-12-30-19/h2-4,8,14-16H,5-7,9-12H2,1H3,(H,27,29)/t14-,15+,16-,25-
InChIKey SQJPLKIUAODTIE-JRVBSRRWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33841
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: 1996631; SBI_ID: SBI-033845
Temperature 318 °C