| SpectraBase Spectrum ID |
8AUHOsKyN6a |
| Name |
(6Z)-6-(1,3-benzodioxol-5-ylmethylene)-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.019432543 u |
| Formula |
C14H10N4O3S2 |
| InChI |
InChI=1S/C14H10N4O3S2/c1-22-14-17-23-13-16-12(19)8(11(15)18(13)14)4-7-2-3-9-10(5-7)21-6-20-9/h2-5,15H,6H2,1H3/b8-4-,15-11? |
| InChIKey |
CKWAXJPNKBISHW-KRYVFPOLSA-N |
| Molecular Weight |
346.379 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_138 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12259795 |
![(6Z)-6-(1,3-benzodioxol-5-ylmethylene)-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one](/api/spectrum/8AUHOsKyN6a/structure.png?h=300&w=458 "(6Z)-6-(1,3-benzodioxol-5-ylmethylene)-5-imino-3-(methylsulfanyl)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one")
