| SpectraBase Spectrum ID |
4kqO2smIjBk |
| Name |
tricyclo[3.3.1.1~3,7~]decane-1-methanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
558.206754493 u |
| Formula |
C28H35ClN4O4S |
| InChI |
InChI=1S/C28H35ClN4O4S/c1-19(28-16-20-12-21(17-28)14-22(13-20)18-28)30-26-15-24(4-7-27(26)33(34)35)31-8-10-32(11-9-31)38(36,37)25-5-2-23(29)3-6-25/h2-7,15,19-22,30H,8-14,16-18H2,1H3/t19?,20-,21+,22-,28- |
| InChIKey |
BRVCJWWDYCPWBG-LQUPWFKPSA-N |
| Molecular Weight |
559.125 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7095 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10220696; Lab Info: LP; Lab Number: LP-2501192 |
| Temperature |
29.85 °C |
![tricyclo[3.3.1.1~3,7~]decane-1-methanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-](/api/spectrum/4kqO2smIjBk/structure.png?h=300&w=458 "tricyclo[3.3.1.1~3,7~]decane-1-methanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-")
