SpectraBase Spectrum ID |
VOdLIEq81e |
Name |
cycloocta[b]thiophene-3-carboxamide, 2-[[[(2-bromobenzoyl)amino]carbonothioyl]amino]-4,5,6,7,8,9-hexahydro- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
465.018032242 u |
Formula |
C19H20BrN3O2S2 |
InChI |
InChI=1S/C19H20BrN3O2S2/c20-13-9-6-5-7-11(13)17(25)22-19(26)23-18-15(16(21)24)12-8-3-1-2-4-10-14(12)27-18/h5-7,9H,1-4,8,10H2,(H2,21,24)(H2,22,23,25,26) |
InChIKey |
SJQXUHDHXFPVQN-UHFFFAOYSA-N |
Molecular Weight |
466.412 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14412 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10322895; Lab Info: OBK; Lab Number: OBK-cor3635 |