| SpectraBase Spectrum ID |
3lTQdAp5NwH |
| Name |
benzoic acid, 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]-, butyl 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 |
493.221285724 u |
| Formula |
C27H31N3O6 |
| InChI |
InChI=1S/C27H31N3O6/c1-2-3-14-34-27(33)20-5-7-21(8-6-20)30-25(31)16-22(26(30)32)29-12-10-28(11-13-29)17-19-4-9-23-24(15-19)36-18-35-23/h4-9,15,22H,2-3,10-14,16-18H2,1H3 |
| InChIKey |
YZWQPKKPACWAMW-UHFFFAOYSA-N |
| Molecular Weight |
493.560 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8610 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10210290; Lab Info: PE; Lab Number: PE-0790119 |
![benzoic acid, 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]-, butyl ester](/api/spectrum/3lTQdAp5NwH/structure.png?h=300&w=458 "benzoic acid, 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl]-, butyl ester")
