SpectraBase Spectrum ID |
4eRAlrDWM9 |
Name |
acetic acid, [[6-[(chloroacetyl)amino]-2-benzothiazolyl]thio]-, ethylester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
344.005612332 u |
Formula |
C13H13ClN2O3S2 |
InChI |
InChI=1S/C13H13ClN2O3S2/c1-2-19-12(18)7-20-13-16-9-4-3-8(5-10(9)21-13)15-11(17)6-14/h3-5H,2,6-7H2,1H3,(H,15,17) |
InChIKey |
HFRGZYWIGBIFGA-UHFFFAOYSA-N |
Molecular Weight |
344.831 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6998 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10220528; Lab Info: LP; Lab Number: LP-0621009 |
Temperature |
23.85 °C |