| SpectraBase Spectrum ID |
8l1VMUqAP2N |
| Name |
1H-purine-2,6-dione, 7-[2-(2-benzoxazolylthio)ethyl]-3,7-dihydro-8-[4-(4-methoxyphenyl)-1-piperazinyl]-1,3-dimethyl- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
547.200173612 u |
| Formula |
C27H29N7O4S |
| InChI |
InChI=1S/C27H29N7O4S/c1-30-23-22(24(35)31(2)27(30)36)34(16-17-39-26-28-20-6-4-5-7-21(20)38-26)25(29-23)33-14-12-32(13-15-33)18-8-10-19(37-3)11-9-18/h4-11H,12-17H2,1-3H3 |
| InChIKey |
RFFCQYFJEDFFCA-UHFFFAOYSA-N |
| Molecular Weight |
547.634 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_219 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13238501 |
![1H-purine-2,6-dione, 7-[2-(2-benzoxazolylthio)ethyl]-3,7-dihydro-8-[4-(4-methoxyphenyl)-1-piperazinyl]-1,3-dimethyl-](/api/spectrum/8l1VMUqAP2N/structure.png?h=300&w=458 "1H-purine-2,6-dione, 7-[2-(2-benzoxazolylthio)ethyl]-3,7-dihydro-8-[4-(4-methoxyphenyl)-1-piperazinyl]-1,3-dimethyl-")
