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2-[1-methyl-2-oxo-3-(2,4,6-trioxocyclohexyl)-2,3-dihydro-1H-indol-3-yl]cyclohexane-1,3,5-trione
SpectraBase Compound ID 64V2gCGTwDC
InChI InChI=1S/C17H13N5O7/c1-22-7-5-3-2-4-6(7)17(14(22)27,8-10(23)18-15(28)19-11(8)24)9-12(25)20-16(29)21-13(9)26/h2-5,8-9H,1H3,(H2,18,19,23,24,28)(H2,20,21,25,26,29)
InChIKey RPVOLLODUQJPPF-UHFFFAOYSA-N
Mol Weight 399.32 g/mol
Molecular Formula C17H13N5O7
Exact Mass 399.081498 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6dGgDWp9xTC
Name 2-[1-methyl-2-oxo-3-(2,4,6-trioxocyclohexyl)-2,3-dihydro-1H-indol-3-yl]cyclohexane-1,3,5-trione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.081497772 u
Formula C17H13N5O7
InChI InChI=1S/C17H13N5O7/c1-22-7-5-3-2-4-6(7)17(14(22)27,8-10(23)18-15(28)19-11(8)24)9-12(25)20-16(29)21-13(9)26/h2-5,8-9H,1H3,(H2,18,19,23,24,28)(H2,20,21,25,26,29)
InChIKey RPVOLLODUQJPPF-UHFFFAOYSA-N
Molecular Weight 399.319 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16683
Solvent DMSO-d6
Source Vendor ID: NMR/10311208; Lab Info: LP; Lab Number: LP-1701202