| SpectraBase Spectrum ID |
CKiT1e49j10 |
| Name |
4(3H)-pyrimidinone, 6-amino-2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.047027016 u |
| Formula |
C13H11N3O4S |
| InChI |
InChI=1S/C13H11N3O4S/c14-11-4-12(18)16-13(15-11)21-5-8(17)7-1-2-9-10(3-7)20-6-19-9/h1-4H,5-6H2,(H3,14,15,16,18) |
| InChIKey |
XCCFHLQVQLLROJ-UHFFFAOYSA-N |
| Molecular Weight |
305.308 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_10021 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9231336; Lab Info: L-23; Lab Number: L-23,Dorofeeva |
![4(3H)-pyrimidinone, 6-amino-2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]-](/api/spectrum/CKiT1e49j10/structure.png?h=300&w=458 "4(3H)-pyrimidinone, 6-amino-2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]thio]-")
