| SpectraBase Spectrum ID |
5bYVyDDJbc0 |
| Name |
7-{2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]ethyl}-8-hexahydro-1H-azepin-1-yl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C21H29N7O2S/c1-14-13-15(2)23-19(22-14)31-12-11-28-16-17(25(3)21(30)26(4)18(16)29)24-20(28)27-9-7-5-6-8-10-27/h13H,5-12H2,1-4H3 |
| InChIKey |
ZJRRSYOKPOZOGX-UHFFFAOYSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_22070 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: D58223; Labnumber: UZ01F011-4271; SBI_ID: SBI-022074 |
| Temperature |
318 °C |
![7-{2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]ethyl}-8-hexahydro-1H-azepin-1-yl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione](/api/spectrum/5bYVyDDJbc0/structure.png?h=300&w=458 "7-{2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]ethyl}-8-hexahydro-1H-azepin-1-yl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione")
