SpectraBase Spectrum ID |
LrKmlg8IaG4 |
Name |
methyl 5-amino-1-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-1H-1,2,3-triazole-4-carboxylate |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
323.078517028 u |
Formula |
C13H14ClN5O3 |
InChI |
InChI=1S/C13H14ClN5O3/c1-7-8(14)4-3-5-9(7)16-10(20)6-19-12(15)11(17-18-19)13(21)22-2/h3-5H,6,15H2,1-2H3,(H,16,20) |
InChIKey |
IGDDYEUZSUXLAY-UHFFFAOYSA-N |
Molecular Weight |
323.740 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_8274 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13219383 |