| SpectraBase Spectrum ID |
JcCzMcxMKhc |
| Name |
ethyl 2-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,⁵]dec-8-en-3-yl)acetate |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.142701049 u |
| Formula |
C21H22N2O7 |
| InChI |
InChI=1S/C21H22N2O7/c1-2-27-16(24)9-23-10-21-6-5-14(30-21)17(18(21)20(23)26)19(25)22-8-12-3-4-13-15(7-12)29-11-28-13/h3-7,14,17-18H,2,8-11H2,1H3,(H,22,25) |
| InChIKey |
DMWCANUAKQJZDS-UHFFFAOYSA-N |
| Molecular Weight |
414.414 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_7254 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12668561 |
![ethyl 2-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,⁵]dec-8-en-3-yl)acetate](/api/spectrum/JcCzMcxMKhc/structure.png?h=300&w=458 "ethyl 2-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-4-oxo-10-oxa-3-azatricyclo[5.2.1.0¹,⁵]dec-8-en-3-yl)acetate")
