SpectraBase Spectrum ID |
9buDVFWQEBj |
Name |
1-piperidinecarboxylic acid, 4-[1,3-dihydro-1,3-dioxo-5-[[[1-(2-thienyl)ethyl]amino]carbonyl]-2H-isoindol-2-yl]-, 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 |
455.151492086 u |
Formula |
C23H25N3O5S |
InChI |
InChI=1S/C23H25N3O5S/c1-3-31-23(30)25-10-8-16(9-11-25)26-21(28)17-7-6-15(13-18(17)22(26)29)20(27)24-14(2)19-5-4-12-32-19/h4-7,12-14,16H,3,8-11H2,1-2H3,(H,24,27) |
InChIKey |
UNNRBWGBSHLQSL-UHFFFAOYSA-N |
Molecular Weight |
455.529 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_1935 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12679524 |