SpectraBase Spectrum ID |
3Hfllu9wt3V |
Name |
benzoic acid, 4-[[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]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 |
337.006204255 u |
Formula |
C13H12BrN3O3 |
InChI |
InChI=1S/C13H12BrN3O3/c1-17-11(10(14)7-15-17)12(18)16-9-5-3-8(4-6-9)13(19)20-2/h3-7H,1-2H3,(H,16,18) |
InChIKey |
NEHZGAPLAZOTFP-UHFFFAOYSA-N |
Molecular Weight |
338.161 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5000 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9263372; Lab Info: PNA; Lab Number: PNA-NA00540 |