SpectraBase Spectrum ID |
AigXihrU4Px |
Name |
benzoic acid, 3-[3,5-dimethyl-4-(3-nitrophenyl)-1H-pyrazol-1-yl]-,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 |
365.137556100 u |
Formula |
C20H19N3O4 |
InChI |
InChI=1S/C20H19N3O4/c1-4-27-20(24)16-8-6-9-17(12-16)22-14(3)19(13(2)21-22)15-7-5-10-18(11-15)23(25)26/h5-12H,4H2,1-3H3 |
InChIKey |
NXOUQJOWOVVNMR-UHFFFAOYSA-N |
Molecular Weight |
365.389 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11575 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10271084; Lab Info: LP; Lab Number: LP-0340232 |
Temperature |
23.85 °C |