| SpectraBase Spectrum ID |
KTwAOUtqM55 |
| Name |
1H-benzimidazole-1-acetic acid, 2-[(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,6-dioxo-1H-purin-8-yl)thio]-, ethyl 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 |
428.126674318 u |
| Formula |
C19H20N6O4S |
| InChI |
InChI=1S/C19H20N6O4S/c1-5-29-13(26)10-25-12-9-7-6-8-11(12)20-18(25)30-17-21-15-14(22(17)2)16(27)24(4)19(28)23(15)3/h6-9H,5,10H2,1-4H3 |
| InChIKey |
GHXUHAJBUZJFBR-UHFFFAOYSA-N |
| Molecular Weight |
428.467 g/mol |
| NMR Offset |
15.0036 |
| NMR Spectrometer Frequency |
250.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_4345 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9273647; Lab Info: LP; Lab Number: LP-3701034 |
| Temperature |
23.85 °C |
![Ethyl {2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1H-benzimidazol-1-yl}acetate](/api/spectrum/KTwAOUtqM55/structure.png?h=300&w=458 "Ethyl {2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-1H-benzimidazol-1-yl}acetate")
