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4-[(3-cyclohexyl-2,4-dioxo-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl)amino]-4-oxobutanoic acid
SpectraBase Compound ID 5ifdeX5JHM4
InChI InChI=1S/C20H21N5O5/c26-15(8-9-16(27)28)21-11-6-7-13-14(10-11)23-18-17(22-13)19(29)25(20(30)24-18)12-4-2-1-3-5-12/h6-7,10,12H,1-5,8-9H2,(H,21,26)(H,27,28)(H,23,24,30)
InChIKey QNHDNTUCYPSAFI-UHFFFAOYSA-N
Mol Weight 411.42 g/mol
Molecular Formula C20H21N5O5
Exact Mass 411.154269 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gd8l4g94JxB
Name 4-[(3-cyclohexyl-2,4-dioxo-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl)amino]-4-oxobutanoic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.154268791 u
Formula C20H21N5O5
InChI InChI=1S/C20H21N5O5/c26-15(8-9-16(27)28)21-11-6-7-13-14(10-11)23-18-17(22-13)19(29)25(20(30)24-18)12-4-2-1-3-5-12/h6-7,10,12H,1-5,8-9H2,(H,21,26)(H,27,28)(H,23,24,30)
InChIKey QNHDNTUCYPSAFI-UHFFFAOYSA-N
Molecular Weight 411.418 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8539
Solvent DMSO-d6
Source Vendor ID: NMR/13219808