SpectraBase Compound ID | LDeQcpEtHb5 |
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InChI | InChI=1S/C25H27N5O3/c1-3-4-5-9-12-21(31)26-18-14-20-19(13-16(18)2)27-22-23(28-20)29-25(33)30(24(22)32)15-17-10-7-6-8-11-17/h6-8,10-11,13-14H,3-5,9,12,15H2,1-2H3,(H,26,31)(H,28,29,33) |
InChIKey | UOHRDKSVFYOQTR-UHFFFAOYSA-N |
Mol Weight | 445.52 g/mol |
Molecular Formula | C25H27N5O3 |
Exact Mass | 445.21139 g/mol |
SpectraBase Spectrum ID | 7OsZnkMGwn2 |
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Name | N-(3-benzyl-7-methyl-2,4-dioxo-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl)heptanamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 445.211389746 u |
Formula | C25H27N5O3 |
InChI | InChI=1S/C25H27N5O3/c1-3-4-5-9-12-21(31)26-18-14-20-19(13-16(18)2)27-22-23(28-20)29-25(33)30(24(22)32)15-17-10-7-6-8-11-17/h6-8,10-11,13-14H,3-5,9,12,15H2,1-2H3,(H,26,31)(H,28,29,33) |
InChIKey | UOHRDKSVFYOQTR-UHFFFAOYSA-N |
Molecular Weight | 445.523 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_8549 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13219823 |