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

*Links on SpectraBase are not permalinks.
2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylene]-1-methyl-, (5Z)-
SpectraBase Compound ID 1QTEyu9u9Nt
InChI InChI=1S/C13H11N3O7/c1-15-12(19)7(11(18)14-13(15)20)3-6-4-8(16(21)22)10(17)9(5-6)23-2/h3-5,17H,1-2H3,(H,14,18,20)/b7-3-
InChIKey PCZCWXWFBSYWAE-CLTKARDFSA-N
Mol Weight 321.25 g/mol
Molecular Formula C13H11N3O7
Exact Mass 321.0597 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 FLRXYozkegI
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylene]-1-methyl-, (5Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.059699699 u
Formula C13H11N3O7
InChI InChI=1S/C13H11N3O7/c1-15-12(19)7(11(18)14-13(15)20)3-6-4-8(16(21)22)10(17)9(5-6)23-2/h3-5,17H,1-2H3,(H,14,18,20)/b7-3-
InChIKey PCZCWXWFBSYWAE-CLTKARDFSA-N
Molecular Weight 321.245 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10937
Solvent DMSO-d6
Source Vendor ID: NMR/9253553; Lab Info: LP; Lab Number: LP-0020639
Temperature 29.85 °C