SpectraBase Spectrum ID |
9PLTHUqlou3 |
Name |
1H-pyrazole-4-carboxylic acid, 5-[[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]acetyl]amino]-1-phenyl-, 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 |
403.077281772 u |
Formula |
C17H17N5O3S2 |
InChI |
InChI=1S/C17H17N5O3S2/c1-3-25-16(24)13-9-18-22(12-7-5-4-6-8-12)15(13)19-14(23)10-26-17-21-20-11(2)27-17/h4-9H,3,10H2,1-2H3,(H,19,23) |
InChIKey |
XDSPYQADIJLUSV-UHFFFAOYSA-N |
Molecular Weight |
403.475 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5258 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9254936; Lab Info: PNA; Lab Number: PNA-NA00476 |