| SpectraBase Spectrum ID |
DHbnJ5LTNnC |
| Name |
1,3,7-trimethyl-8-({1-[2-oxo-2-(1-piperidinyl)ethyl]-1H-benzimidazol-2-yl}sulfanyl)-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/C22H25N7O3S/c1-25-17-18(26(2)22(32)27(3)19(17)31)24-20(25)33-21-23-14-9-5-6-10-15(14)29(21)13-16(30)28-11-7-4-8-12-28/h5-6,9-10H,4,7-8,11-13H2,1-3H3 |
| InChIKey |
XUMRWILQHXFYPK-UHFFFAOYSA-N |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_SBI_36227_2821 |
| 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: D04873; Labnumber: MVERET-0909; SBI_ID: SBI-002823 |
| Temperature |
318 °C |
![1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[[1-[2-oxo-2-(1-piperidinyl)ethyl]-1H-benzimidazol-2-yl]thio]-](/api/spectrum/DHbnJ5LTNnC/structure.png?h=300&w=458 "1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[[1-[2-oxo-2-(1-piperidinyl)ethyl]-1H-benzimidazol-2-yl]thio]-")
