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(4aR,4bS,7aR,8S)-8-(3,4-dimethoxybenzoyl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
SpectraBase Compound ID 2WgoDvJVC0v
InChI InChI=1S/C18H17N3O5/c1-25-11-6-5-9(8-12(11)26-2)16(22)15-14-13(17(23)20-18(14)24)10-4-3-7-19-21(10)15/h3-8,10,13-15H,1-2H3,(H,20,23,24)
InChIKey ISAKRASHNOEHJJ-UHFFFAOYSA-N
Mol Weight 355.35 g/mol
Molecular Formula C18H17N3O5
Exact Mass 355.116821 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 825GnVT1IGt
Name (4aR,4bS,7aR,8S)-8-(3,4-dimethoxybenzoyl)-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/C18H17N3O5/c1-25-11-6-5-9(8-12(11)26-2)16(22)15-14-13(17(23)20-18(14)24)10-4-3-7-19-21(10)15/h3-8,10,13-15H,1-2H3,(H,20,23,24)
InChIKey ISAKRASHNOEHJJ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6464
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: D14881; Labnumber: NNA05-371; SBI_ID: SBI-006467
Temperature 306 °C