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(4aR,4bS,7aR,8S)-8-(4-fluorobenzoyl)-6-(4-methylphenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione

View entire compound with spectra: 1 NMR

(4aR,4bS,7aR,8S)-8-(4-fluorobenzoyl)-6-(4-methylphenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
SpectraBase Compound ID 4OtsDBlt0cu
InChI InChI=1S/C23H18FN3O3/c1-13-4-10-16(11-5-13)26-22(29)18-17-3-2-12-25-27(17)20(19(18)23(26)30)21(28)14-6-8-15(24)9-7-14/h2-12,17-20H,1H3
InChIKey ARZGQVJZXWLCSS-UHFFFAOYSA-N
Mol Weight 403.41 g/mol
Molecular Formula C23H18FN3O3
Exact Mass 403.13322 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8ZP9guDkRHR
Name (4aR,4bS,7aR,8S)-8-(4-fluorobenzoyl)-6-(4-methylphenyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
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/C23H18FN3O3/c1-13-4-10-16(11-5-13)26-22(29)18-17-3-2-12-25-27(17)20(19(18)23(26)30)21(28)14-6-8-15(24)9-7-14/h2-12,17-20H,1H3
InChIKey ARZGQVJZXWLCSS-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16347
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: D23301; Labnumber: NNA05-449; SBI_ID: SBI-016350
Temperature 318 °C