| SpectraBase Spectrum ID |
Ea2QPKuUCSD |
| Name |
2-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-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 |
487.113268647 u |
| Formula |
C24H23ClFN3O3S |
| InChI |
InChI=1S/C24H23ClFN3O3S/c1-29-8-7-16-20(11-29)33-24-21(16)23(30)27-22(28-24)13-3-6-19(31-2)14(9-13)12-32-15-4-5-18(26)17(25)10-15/h3-6,9-10,22,28H,7-8,11-12H2,1-2H3,(H,27,30) |
| InChIKey |
REROTBUHHALGGF-UHFFFAOYSA-N |
| Molecular Weight |
487.977 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_3420 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12289267 |
![2-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one](/api/spectrum/Ea2QPKuUCSD/structure.png?h=300&w=458 "2-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one")
