| SpectraBase Spectrum ID |
IOQFjje8oRk |
| Name |
benzeneacetonitrile, alpha-[[3-ethoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-3-yl)methoxy]phenyl]methylene]-4-nitro- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
422.122634310 u |
| Formula |
C21H18N4O6 |
| InChI |
InChI=1S/C21H18N4O6/c1-3-29-21-11-15(4-9-20(21)30-13-19-14(2)23-31-25(19)28)10-17(12-22)16-5-7-18(8-6-16)24(26)27/h4-11H,3,13H2,1-2H3/b17-10+ |
| InChIKey |
BPKHRLGWVWLHOF-LICLKQGHSA-N |
| Molecular Weight |
422.397 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_4741 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9290220; Lab Info: LP; Lab Number: LP-4034006 |
![benzeneacetonitrile, alpha-[[3-ethoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-3-yl)methoxy]phenyl]methylene]-4-nitro-](/api/spectrum/IOQFjje8oRk/structure.png?h=300&w=458 "benzeneacetonitrile, alpha-[[3-ethoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-3-yl)methoxy]phenyl]methylene]-4-nitro-")
