SpectraBase Spectrum ID |
HYz0REdAC2E |
Name |
1H-isoindole-2-hexanamide, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-2,3-dihydro-1,3-dioxo- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
407.130362719 u |
Formula |
C22H21N3O3S |
InChI |
InChI=1S/C22H21N3O3S/c23-13-17-14-9-6-10-18(14)29-20(17)24-19(26)11-2-1-5-12-25-21(27)15-7-3-4-8-16(15)22(25)28/h3-4,7-8H,1-2,5-6,9-12H2,(H,24,26) |
InChIKey |
OTMMWCGRQMSOLI-UHFFFAOYSA-N |
Molecular Weight |
407.488 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15865 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11240812; Lab Info: L-02; Lab Number: L-0200005 |