SpectraBase Spectrum ID |
IQzBXfTzton |
Name |
benzoic acid, 4-[[[(2Z)-tetrahydro-4-oxo-2-(phenylimino)-3-(phenylmethyl)-2H-1,3-thiazin-6-yl]carbonyl]amino]-, ethyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
487.156577467 u |
Formula |
C27H25N3O4S |
InChI |
InChI=1S/C27H25N3O4S/c1-2-34-26(33)20-13-15-22(16-14-20)28-25(32)23-17-24(31)30(18-19-9-5-3-6-10-19)27(35-23)29-21-11-7-4-8-12-21/h3-16,23H,2,17-18H2,1H3,(H,28,32)/b29-27- |
InChIKey |
OYNKIOHSCFSAEM-OHYPFYFLSA-N |
Molecular Weight |
487.574 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_13010 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10215607; Lab Info: L-04; Lab Number: NMR/9251833 |