| SpectraBase Spectrum ID |
K205q2jkGRV |
| Name |
benzoic acid, 4-[2,5-dioxo-3-(4-tricyclo[3.3.1.1~3,7~]dec-1-yl-1-piperazinyl)-1-pyrrolidinyl]-, ethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
465.262756615 u |
| Formula |
C27H35N3O4 |
| InChI |
InChI=1S/C27H35N3O4/c1-2-34-26(33)21-3-5-22(6-4-21)30-24(31)14-23(25(30)32)28-7-9-29(10-8-28)27-15-18-11-19(16-27)13-20(12-18)17-27/h3-6,18-20,23H,2,7-17H2,1H3/t18-,19+,20-,23?,27- |
| InChIKey |
SIWJEQCDEALYFL-BABRQVGDSA-N |
| Molecular Weight |
465.594 g/mol |
| NMR Offset |
17.9888 |
| NMR Spectrometer Frequency |
500.132 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16016 |
| Solvent |
CDCl3 |
| Source |
Vendor ID: NMR/11230012; Lab Info: PE; Lab Number: PE-0103010 |
![4-[3-[4-(1-adamantyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]benzoic acid ethyl ester](/api/spectrum/K205q2jkGRV/structure.png?h=300&w=458 "4-[3-[4-(1-adamantyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]benzoic acid ethyl ester")
