SpectraBase Spectrum ID |
Dn5AK4UV0Jf |
Name |
1,2-dimethyl-3-[2-oxo-2-(thiophen-2-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-2-ylium bromide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
351.004096256 u |
Formula |
C14H14BrN3OS |
InChI |
InChI=1S/C14H14N3OS.BrH/c1-16-10-5-2-3-6-11(10)17(14(16)15)9-12(18)13-7-4-8-19-13;/h2-8H,9,15H2,1H3;1H/q+1;/p-1 |
InChIKey |
JHNXEQRGUHTCDU-UHFFFAOYSA-M |
Molecular Weight |
352.250 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4631 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9313915; Lab Info: POV; Lab Number: POV-0300074 |