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isoxazolo[5,4-b]pyridine, 6-cyclopropyl-3-(4-fluorophenyl)-4-[(hexahydro-1H-azepin-1-yl)carbonyl]-
SpectraBase Compound ID ERhkpJiHX5q
InChI InChI=1S/C22H22FN3O2/c23-16-9-7-15(8-10-16)20-19-17(22(27)26-11-3-1-2-4-12-26)13-18(14-5-6-14)24-21(19)28-25-20/h7-10,13-14H,1-6,11-12H2
InChIKey ANPQZOLMDZHWLT-UHFFFAOYSA-N
Mol Weight 379.44 g/mol
Molecular Formula C22H22FN3O2
Exact Mass 379.169605 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EiThqhomp6j
Name isoxazolo[5,4-b]pyridine, 6-cyclopropyl-3-(4-fluorophenyl)-4-[(hexahydro-1H-azepin-1-yl)carbonyl]-
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/C22H22FN3O2/c23-16-9-7-15(8-10-16)20-19-17(22(27)26-11-3-1-2-4-12-26)13-18(14-5-6-14)24-21(19)28-25-20/h7-10,13-14H,1-6,11-12H2
InChIKey ANPQZOLMDZHWLT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_24167
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: 2318007; UZI_ID: UZI-024175
Temperature 308 °C