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Pyrimidine-2,4,6(1H,3H,5H)-trione, 1-tert-butyl-5-(3-indolylmethylene)-

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Pyrimidine-2,4,6(1H,3H,5H)-trione, 1-tert-butyl-5-(3-indolylmethylene)-
SpectraBase Compound ID G1c0qWG5ZyF
InChI InChI=1S/C17H17N3O3/c1-17(2,3)20-15(22)12(14(21)19-16(20)23)8-10-9-18-13-7-5-4-6-11(10)13/h4-9,18H,1-3H3,(H,19,21,23)/b12-8+
InChIKey JTBSTMPPMLOUSX-XYOKQWHBSA-N
Mol Weight 311.34 g/mol
Molecular Formula C17H17N3O3
Exact Mass 311.126991 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kg8vRJUqjS0
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 1-(1,1-dimethylethyl)-5-(1H-indol-3-ylmethylene)-, (5E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.126991416 u
Formula C17H17N3O3
InChI InChI=1S/C17H17N3O3/c1-17(2,3)20-15(22)12(14(21)19-16(20)23)8-10-9-18-13-7-5-4-6-11(10)13/h4-9,18H,1-3H3,(H,19,21,23)/b12-8+
InChIKey JTBSTMPPMLOUSX-XYOKQWHBSA-N
Molecular Weight 311.341 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5083
Solvent DMSO-d6
Source Vendor ID: NMR/9301132; Lab Info: LP; Lab Number: LP-1701118