SpectraBase Spectrum ID |
3GCVpszrhP1 |
Name |
acetic acid, [4-[(E)-[(2E)-2-[(2-chlorophenyl)imino]-4-oxothiazolidinylidene]methyl]-2-methoxyphenoxy]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
418.039020460 u |
Formula |
C19H15ClN2O5S |
InChI |
InChI=1S/C19H15ClN2O5S/c1-26-15-8-11(6-7-14(15)27-10-17(23)24)9-16-18(25)22-19(28-16)21-13-5-3-2-4-12(13)20/h2-9H,10H2,1H3,(H,23,24)(H,21,22,25)/b16-9+ |
InChIKey |
SMBOJKBAOBQNRG-CXUHLZMHSA-N |
Molecular Weight |
418.851 g/mol |
NMR Offset |
16.0087 |
NMR Spectrometer Frequency |
500.133 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4202 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9214189; Lab Info: LP; Lab Number: LP-0221776 |