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3-[2-(3,4-dihydroxyphenyl)ethyl]-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
SpectraBase Compound ID B03AwlNpNY3
InChI InChI=1S/C19H17N3O4/c1-26-12-3-4-13-14(9-12)21-18-17(13)20-10-22(19(18)25)7-6-11-2-5-15(23)16(24)8-11/h2-5,8-10,21,23-24H,6-7H2,1H3
InChIKey JVRFXGXRBFCECJ-UHFFFAOYSA-N
Mol Weight 351.36 g/mol
Molecular Formula C19H17N3O4
Exact Mass 351.121906 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6QFvC0sLJF3
Name 3-[2-(3,4-dihydroxyphenyl)ethyl]-7-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
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/C19H17N3O4/c1-26-12-3-4-13-14(9-12)21-18-17(13)20-10-22(19(18)25)7-6-11-2-5-15(23)16(24)8-11/h2-5,8-10,21,23-24H,6-7H2,1H3
InChIKey JVRFXGXRBFCECJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18203
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: D32030; Labnumber: SIMAK-01497; SBI_ID: SBI-018206
Temperature 308 °C