SpectraBase Spectrum ID |
Km0ac4mR4o2 |
Name |
acetamide, N-[4-[(5E)-5-[[4-(acetyloxy)-2-chloro-5-methoxyphenyl]methylene]-2-imino-4-oxothiazolidinyl]-1,2,5-oxadiazol-3-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 |
451.035332059 u |
Formula |
C17H14ClN5O6S |
InChI |
InChI=1S/C17H14ClN5O6S/c1-7(24)20-14-15(22-29-21-14)23-16(26)13(30-17(23)19)5-9-4-11(27-3)12(6-10(9)18)28-8(2)25/h4-6,19H,1-3H3,(H,20,21,24)/b13-5+,19-17? |
InChIKey |
PSYFQZDSOHMIHD-SRNIEEMRSA-N |
Molecular Weight |
451.841 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14629 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10310752; Lab Info: SAD; Lab Number: 92 |