| SpectraBase Spectrum ID |
LljcHGUscly |
| Name |
tricyclo[3.3.1.1~3,7~]decane-1-methanamine, alpha-methyl-N-[2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]phenyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
524.245726825 u |
| Formula |
C28H36N4O4S |
| InChI |
InChI=1S/C28H36N4O4S/c1-20(28-17-21-13-22(18-28)15-23(14-21)19-28)29-26-16-24(7-8-27(26)32(33)34)30-9-11-31(12-10-30)37(35,36)25-5-3-2-4-6-25/h2-8,16,20-23,29H,9-15,17-19H2,1H3 |
| InChIKey |
KKYKETVAZABVDI-UHFFFAOYSA-N |
| Molecular Weight |
524.680 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6850 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9321040; Lab Info: LP; Lab Number: LP-2501063 |
| Temperature |
23.85 °C |
![tricyclo[3.3.1.1~3,7~]decane-1-methanamine, alpha-methyl-N-[2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]phenyl]-](/api/spectrum/LljcHGUscly/structure.png?h=300&w=458 "tricyclo[3.3.1.1~3,7~]decane-1-methanamine, alpha-methyl-N-[2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]phenyl]-")
