| SpectraBase Spectrum ID |
JViI17mPkgC |
| Name |
tricyclo[3.3.1.1~3,7~]decane-1-methanamine, alpha-methyl-N-[5-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
538.261376890 u |
| Formula |
C29H38N4O4S |
| InChI |
InChI=1S/C29H38N4O4S/c1-20-3-6-26(7-4-20)38(36,37)32-11-9-31(10-12-32)25-5-8-28(33(34)35)27(16-25)30-21(2)29-17-22-13-23(18-29)15-24(14-22)19-29/h3-8,16,21-24,30H,9-15,17-19H2,1-2H3/t21?,22-,23+,24-,29- |
| InChIKey |
CSXHCGJWBFCUPP-JXTDQGMBSA-N |
| Molecular Weight |
538.707 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7103 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10220705; Lab Info: LP; Lab Number: LP-2501201 |
| Temperature |
29.85 °C |
![tricyclo[3.3.1.1~3,7~]decane-1-methanamine, alpha-methyl-N-[5-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-](/api/spectrum/JViI17mPkgC/structure.png?h=300&w=458 "tricyclo[3.3.1.1~3,7~]decane-1-methanamine, alpha-methyl-N-[5-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-")
