| SpectraBase Spectrum ID |
H1DdldWLedG |
| Name |
acetic acid, [(7-butyl-2,3,6,7-tetrahydro-3-methyl-2,6-dioxo-1H-purin-8-yl)thio]-, pentyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.167476503 u |
| Formula |
C17H26N4O4S |
| InChI |
InChI=1S/C17H26N4O4S/c1-4-6-8-10-25-12(22)11-26-17-18-14-13(21(17)9-7-5-2)15(23)19-16(24)20(14)3/h4-11H2,1-3H3,(H,19,23,24) |
| InChIKey |
JMTNEYSBKYKOFX-UHFFFAOYSA-N |
| Molecular Weight |
382.479 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_3080 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9258467; Lab Number: BAS 0964130 |
| Temperature |
29.85 °C |
![acetic acid, [(7-butyl-2,3,6,7-tetrahydro-3-methyl-2,6-dioxo-1H-purin-8-yl)thio]-, pentyl ester](/api/spectrum/H1DdldWLedG/structure.png?h=300&w=458 "acetic acid, [(7-butyl-2,3,6,7-tetrahydro-3-methyl-2,6-dioxo-1H-purin-8-yl)thio]-, pentyl ester")
