| SpectraBase Spectrum ID |
1FwPi4ya9wj |
| Name |
1H-purine-2,6-dione, 7-butyl-8-[[(2Z)-3-chloro-2-butenyl]thio]-3,7-dihydro-3-methyl- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.091724740 u |
| Formula |
C14H19ClN4O2S |
| InChI |
InChI=1S/C14H19ClN4O2S/c1-4-5-7-19-10-11(18(3)13(21)17-12(10)20)16-14(19)22-8-6-9(2)15/h6H,4-5,7-8H2,1-3H3,(H,17,20,21)/b9-6- |
| InChIKey |
PRLKHSKACRDFGY-TWGQIWQCSA-N |
| Molecular Weight |
342.845 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_3079 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9258465; Lab Info: *0964117*; Lab Number: BAS 0964117 |
| Temperature |
29.85 °C |
![1H-purine-2,6-dione, 7-butyl-8-[[(2Z)-3-chloro-2-butenyl]thio]-3,7-dihydro-3-methyl-](/api/spectrum/1FwPi4ya9wj/structure.png?h=300&w=458 "1H-purine-2,6-dione, 7-butyl-8-[[(2Z)-3-chloro-2-butenyl]thio]-3,7-dihydro-3-methyl-")
