SpectraBase Spectrum ID |
FuqBtqQOTAX |
Name |
alanine, 3,3,3-trifluoro-N-(2-methoxybenzoyl)-2-[(4-methyl-2-thiazolyl)amino]-, methyl 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 |
403.081361666 u |
Formula |
C16H16F3N3O4S |
InChI |
InChI=1S/C16H16F3N3O4S/c1-9-8-27-14(20-9)22-15(13(24)26-3,16(17,18)19)21-12(23)10-6-4-5-7-11(10)25-2/h4-8H,1-3H3,(H,20,22)(H,21,23) |
InChIKey |
UKUZTEUJWUMKOE-UHFFFAOYSA-N |
Molecular Weight |
403.376 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15089 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10321909; Lab Info: AU; Lab Number: AU-CG00233 |