| SpectraBase Spectrum ID |
IJl9MgFJFFz |
| Name |
7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-(1,3-benzodioxol-5-ylmethylene)-2-heptyl-5,6-dihydro-5-imino-, (6Z)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.141261755 u |
| Formula |
C20H22N4O3S |
| InChI |
InChI=1S/C20H22N4O3S/c1-2-3-4-5-6-7-17-23-24-18(21)14(19(25)22-20(24)28-17)10-13-8-9-15-16(11-13)27-12-26-15/h8-11,21H,2-7,12H2,1H3/b14-10-,21-18? |
| InChIKey |
NJDOMRZXSYUCAV-CTLFBJNRSA-N |
| Molecular Weight |
398.481 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15574 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/10032808; Lab Info: CEP; Lab Number: CEP-6700102 |
![7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-(1,3-benzodioxol-5-ylmethylene)-2-heptyl-5,6-dihydro-5-imino-, (6Z)-](/api/spectrum/IJl9MgFJFFz/structure.png?h=300&w=458 "7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-(1,3-benzodioxol-5-ylmethylene)-2-heptyl-5,6-dihydro-5-imino-, (6Z)-")
