SpectraBase Spectrum ID |
2F3AtYa3han |
Name |
3-thiophenecarboxylic acid, 4,5-dimethyl-2-[[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]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 |
353.079389772 u |
Formula |
C13H15N5O5S |
InChI |
InChI=1S/C13H15N5O5S/c1-4-23-12(20)10-7(2)8(3)24-11(10)15-9(19)5-17-6-14-13(16-17)18(21)22/h6H,4-5H2,1-3H3,(H,15,19) |
InChIKey |
MYWCAYNMUURAFL-UHFFFAOYSA-N |
Molecular Weight |
353.353 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8342 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9322122; Lab Info: PNA; Lab Number: PNA-NA00851 |
Temperature |
29.85 °C |