SpectraBase Spectrum ID |
YY65LYRBs |
Name |
6-acetyl-5-methyl-4H,5H,6H-[1,3]thiazolo[3,2-a][1,5]benzodiazepin-11-ium 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 |
338.008847284 u |
Formula |
C14H15BrN2OS |
InChI |
InChI=1S/C14H15N2OS.BrH/c1-10-9-14-15(7-8-18-14)12-5-3-4-6-13(12)16(10)11(2)17;/h3-8,10H,9H2,1-2H3;1H/q+1;/p-1 |
InChIKey |
BUWDXBAFBZNBED-UHFFFAOYSA-M |
Molecular Weight |
339.251 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_5787 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12273473; Lab Info: YAN; Lab Number: YAN-0209010 |