SpectraBase Spectrum ID |
DJ6nGIaNYx6 |
Name |
urea, N-(4-chlorophenyl)-N'-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
331.054610956 u |
Formula |
C16H14ClN3OS |
InChI |
InChI=1S/C16H14ClN3OS/c17-10-5-7-11(8-6-10)19-16(21)20-15-13(9-18)12-3-1-2-4-14(12)22-15/h5-8H,1-4H2,(H2,19,20,21) |
InChIKey |
CHTWFXJHJLJOMB-UHFFFAOYSA-N |
Molecular Weight |
331.821 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5333 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9290907; Lab Info: AU; Lab Number: AU-EC00881 |