SpectraBase Spectrum ID |
CF0vmsSBRAs |
Name |
benzoic acid, 4-[[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]amino]-, ethylester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
291.096753915 u |
Formula |
C12H13N5O4 |
InChI |
InChI=1S/C12H13N5O4/c1-2-21-11(18)9-3-5-10(6-4-9)13-7-16-8-14-12(15-16)17(19)20/h3-6,8,13H,2,7H2,1H3 |
InChIKey |
WLHWAROPPKVONV-UHFFFAOYSA-N |
Molecular Weight |
291.267 g/mol |
NMR Offset |
17.9879 |
NMR Spectrometer Frequency |
500.132 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16321 |
Solvent |
CDCl3 |
Source |
Vendor ID: NMR/10320162; Lab Info: KAG; Lab Number: KAG-COR0002 |