| SpectraBase Spectrum ID |
BBlFuXv3EGj |
| Name |
4-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)-1,3-benzenediol |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.138284374 u |
| Formula |
C16H20N4O6 |
| InChI |
InChI=1S/C16H20N4O6/c1-14(2)15(19(23)24)6-17-8-16(14,20(25)26)9-18(7-15)13(17)11-4-3-10(21)5-12(11)22/h3-5,13,21-22H,6-9H2,1-2H3/t13-,15-,16+ |
| InChIKey |
IRVPOUPDLUTUHJ-MKZZRHPPSA-N |
| Molecular Weight |
364.358 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_4339 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12272496; Lab Info: ARU; Lab Number: edi-01246 |
![4-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)-1,3-benzenediol](/api/spectrum/BBlFuXv3EGj/structure.png?h=300&w=458 "4-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)-1,3-benzenediol")
