| SpectraBase Spectrum ID |
Ik5K5MGZJFh |
| Name |
3-(heptylsulfanyl)-6-(5-nitro-2-furyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
441.147075411 u |
| Formula |
C21H23N5O4S |
| InChI |
InChI=1S/C21H23N5O4S/c1-2-3-4-5-8-13-31-21-23-20-18(24-25-21)14-9-6-7-10-15(14)22-19(30-20)16-11-12-17(29-16)26(27)28/h6-7,9-12,19,22H,2-5,8,13H2,1H3 |
| InChIKey |
SLECBSBYIZHXMC-UHFFFAOYSA-N |
| Molecular Weight |
441.506 g/mol |
| NMR Offset |
17.9891 |
| NMR Spectrometer Frequency |
500.132 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_3230 |
| Solvent |
CDCl3 |
| Source |
Vendor ID: NMR/12288643 |
![3-(heptylsulfanyl)-6-(5-nitro-2-furyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine](/api/spectrum/Ik5K5MGZJFh/structure.png?h=300&w=458 "3-(heptylsulfanyl)-6-(5-nitro-2-furyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine")
