SpectraBase Compound ID | DiLE9kpI4wA |
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InChI | InChI=1S/C27H31N5O3/c1-2-3-4-5-6-10-13-23(33)28-20-14-15-21-22(18-20)30-25-24(29-21)26(34)32(27(35)31-25)17-16-19-11-8-7-9-12-19/h7-9,11-12,14-15,18H,2-6,10,13,16-17H2,1H3,(H,28,33)(H,30,31,35) |
InChIKey | NYCUWBIBZOOKMJ-UHFFFAOYSA-N |
Mol Weight | 473.58 g/mol |
Molecular Formula | C27H31N5O3 |
Exact Mass | 473.24269 g/mol |
SpectraBase Spectrum ID | 56z7GvcrmZg |
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Name | N-[2,4-dioxo-3-(2-phenylethyl)-1,2,3,4-tetrahydrobenzo[g]pteridin-8-yl]nonanamide |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 473.242689875 u |
Formula | C27H31N5O3 |
InChI | InChI=1S/C27H31N5O3/c1-2-3-4-5-6-10-13-23(33)28-20-14-15-21-22(18-20)30-25-24(29-21)26(34)32(27(35)31-25)17-16-19-11-8-7-9-12-19/h7-9,11-12,14-15,18H,2-6,10,13,16-17H2,1H3,(H,28,33)(H,30,31,35) |
InChIKey | NYCUWBIBZOOKMJ-UHFFFAOYSA-N |
Molecular Weight | 473.577 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2020_8552 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/13219829 |