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3H-pyrimido[4',5':4,5]pyrrolo[1,2-a]azepine-11-carbonitrile, 4,6,7,8,9,10-hexahydro-3-[2-(4-methoxyphenyl)-2-oxoethyl]-4-oxo-
SpectraBase Compound ID D1P2m9IaVT7
InChI InChI=1S/C21H20N4O3/c1-28-15-8-6-14(7-9-15)18(26)12-24-13-23-19-16(11-22)17-5-3-2-4-10-25(17)20(19)21(24)27/h6-9,13H,2-5,10,12H2,1H3
InChIKey DHOFMSLXURSNAL-UHFFFAOYSA-N
Mol Weight 376.42 g/mol
Molecular Formula C21H20N4O3
Exact Mass 376.153541 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 51HgExoR0pd
Name 3H-pyrimido[4',5':4,5]pyrrolo[1,2-a]azepine-11-carbonitrile, 4,6,7,8,9,10-hexahydro-3-[2-(4-methoxyphenyl)-2-oxoethyl]-4-oxo-
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/C21H20N4O3/c1-28-15-8-6-14(7-9-15)18(26)12-24-13-23-19-16(11-22)17-5-3-2-4-10-25(17)20(19)21(24)27/h6-9,13H,2-5,10,12H2,1H3
InChIKey DHOFMSLXURSNAL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6460
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/10266667