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methyl {3-[(Z)-(1-(1,3-benzodioxol-5-yl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}acetate
SpectraBase Compound ID o9lfUUSYKa
InChI InChI=1S/C23H17N3O7/c1-31-20(27)11-25-10-13(15-4-2-3-5-17(15)25)8-16-21(28)24-23(30)26(22(16)29)14-6-7-18-19(9-14)33-12-32-18/h2-10H,11-12H2,1H3,(H,24,28,30)/b16-8-
InChIKey QZPHLPLNHVQFKM-PXNMLYILSA-N
Mol Weight 447.4 g/mol
Molecular Formula C23H17N3O7
Exact Mass 447.10665 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7Wf4TU1iqGK
Name methyl {3-[(Z)-(1-(1,3-benzodioxol-5-yl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}acetate
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/C23H17N3O7/c1-31-20(27)11-25-10-13(15-4-2-3-5-17(15)25)8-16-21(28)24-23(30)26(22(16)29)14-6-7-18-19(9-14)33-12-32-18/h2-10H,11-12H2,1H3,(H,24,28,30)/b16-8-
InChIKey QZPHLPLNHVQFKM-PXNMLYILSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9676
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: 133700; Labnumber: AREF2K-3028; VK_ID: VK-009680
Synonyms methyl {3-[(1-(1,3-benzodioxol-5-yl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-1H-indol-1-yl}acetate
Temperature 315 °C