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6H-anthra[1,9-cd]isoxazol-6-one, 3-[4-(2-fluorophenyl)-1-piperazinyl]-5-[(3,4,5-trimethoxyphenyl)amino]-
SpectraBase Compound ID CSfdZWACmr7
InChI InChI=1S/C33H29FN4O5/c1-40-26-16-19(17-27(41-2)33(26)42-3)35-23-18-25(38-14-12-37(13-15-38)24-11-7-6-10-22(24)34)30-29-28(23)31(39)20-8-4-5-9-21(20)32(29)43-36-30/h4-11,16-18,35H,12-15H2,1-3H3
InChIKey KUKVQKMRFRVWKZ-UHFFFAOYSA-N
Mol Weight 580.6 g/mol
Molecular Formula C33H29FN4O5
Exact Mass 580.212198 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HvW1NLaLGiY
Name 6H-anthra[1,9-cd]isoxazol-6-one, 3-[4-(2-fluorophenyl)-1-piperazinyl]-5-[(3,4,5-trimethoxyphenyl)amino]-
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/C33H29FN4O5/c1-40-26-16-19(17-27(41-2)33(26)42-3)35-23-18-25(38-14-12-37(13-15-38)24-11-7-6-10-22(24)34)30-29-28(23)31(39)20-8-4-5-9-21(20)32(29)43-36-30/h4-11,16-18,35H,12-15H2,1-3H3
InChIKey KUKVQKMRFRVWKZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_6577
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/11328918