For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-[6-hydroxy-3-(3-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium chloride

View entire compound with spectra: 1 NMR

1-[6-hydroxy-3-(3-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium chloride
SpectraBase Compound ID J9KyML7B5jt
InChI InChI=1S/C22H20N4O3.ClH/c1-12-5-4-6-13(11-12)26-21(28)17(20(27)25-22(26)29)19-18-15(9-10-23-19)14-7-2-3-8-16(14)24-18;/h2-8,11,19,23-24,27H,9-10H2,1H3,(H,25,29);1H
InChIKey AILWFNCMSVRWLG-UHFFFAOYSA-N
Mol Weight 424.89 g/mol
Molecular Formula C22H21ClN4O3
Exact Mass 424.130218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CaayxmyikRl
Name 1-[6-hydroxy-3-(3-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl]-2,3,4,9-tetrahydro-1H-beta-carbolin-2-ium chloride
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/C22H20N4O3.ClH/c1-12-5-4-6-13(11-12)26-21(28)17(20(27)25-22(26)29)19-18-15(9-10-23-19)14-7-2-3-8-16(14)24-18;/h2-8,11,19,23-24,27H,9-10H2,1H3,(H,25,29);1H
InChIKey AILWFNCMSVRWLG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23403
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: D40305; Labnumber: NC98SP32-1498; SBI_ID: SBI-023407
Temperature 308 °C