| SpectraBase Spectrum ID |
3fnrUDxIfkA |
| Name |
4-nitro-5-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)phthalonitrile |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.117489360 u |
| Formula |
C19H15N5O3 |
| InChI |
InChI=1S/C19H15N5O3/c20-7-13-5-17(18(24(26)27)6-14(13)8-21)22-9-12-4-15(11-22)16-2-1-3-19(25)23(16)10-12/h1-3,5-6,12,15H,4,9-11H2 |
| InChIKey |
BMAFYQCEWBHPNE-UHFFFAOYSA-N |
| Molecular Weight |
361.361 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6042 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10211861; Lab Info: AI; Lab Number: AIS-S001120 |
![4-Nitro-5-(8-oxo-1,5,6,8-tetrahydro-2H,4H-1,5-methano-pyrido[1,2-a][1,5]diazocin-3-yl)-phthalonitrile](/api/spectrum/3fnrUDxIfkA/structure.png?h=300&w=458 "4-Nitro-5-(8-oxo-1,5,6,8-tetrahydro-2H,4H-1,5-methano-pyrido[1,2-a][1,5]diazocin-3-yl)-phthalonitrile")
