| SpectraBase Spectrum ID |
IJ408tuct2S |
| Name |
1-benzyl-4-{(1Z)-3,4,4-trichloro-1-[(4-methylphenyl)sulfanyl]-2-nitro-1,3-butadienyl}piperazine |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
497.049831232 u |
| Formula |
C22H22Cl3N3O2S |
| InChI |
InChI=1S/C22H22Cl3N3O2S/c1-16-7-9-18(10-8-16)31-22(20(28(29)30)19(23)21(24)25)27-13-11-26(12-14-27)15-17-5-3-2-4-6-17/h2-10H,11-15H2,1H3/b22-20- |
| InChIKey |
DKRMMPKEFZAVKU-XDOYNYLZSA-N |
| Molecular Weight |
498.856 g/mol |
| NMR Offset |
17.9889 |
| NMR Spectrometer Frequency |
500.132 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_4204 |
| Solvent |
CDCl3 |
| Source |
Vendor ID: NMR/12308866 |
![1-benzyl-4-{(1Z)-3,4,4-trichloro-1-[(4-methylphenyl)sulfanyl]-2-nitro-1,3-butadienyl}piperazine](/api/spectrum/IJ408tuct2S/structure.png?h=300&w=458 "1-benzyl-4-{(1Z)-3,4,4-trichloro-1-[(4-methylphenyl)sulfanyl]-2-nitro-1,3-butadienyl}piperazine")
