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6H-anthra[1,9-cd]isoxazol-6-one, 5-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-[4-(2-fluorophenyl)-1-piperazinyl]-
SpectraBase Compound ID DIZOpNldbah
InChI InChI=1S/C32H25FN4O4/c33-22-7-3-4-8-24(22)36-11-13-37(14-12-36)25-18-23(34-19-9-10-26-27(17-19)40-16-15-39-26)28-29-30(25)35-41-32(29)21-6-2-1-5-20(21)31(28)38/h1-10,17-18,34H,11-16H2
InChIKey KOWRJBPCQIUYNS-UHFFFAOYSA-N
Mol Weight 548.6 g/mol
Molecular Formula C32H25FN4O4
Exact Mass 548.185983 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JJtFP9Ln57W
Name 6H-anthra[1,9-cd]isoxazol-6-one, 5-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-3-[4-(2-fluorophenyl)-1-piperazinyl]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C32H25FN4O4/c33-22-7-3-4-8-24(22)36-11-13-37(14-12-36)25-18-23(34-19-9-10-26-27(17-19)40-16-15-39-26)28-29-30(25)35-41-32(29)21-6-2-1-5-20(21)31(28)38/h1-10,17-18,34H,11-16H2
InChIKey KOWRJBPCQIUYNS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6578
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: NMR/11328919