| SpectraBase Spectrum ID |
KnITSVivjcl |
| Name |
benzoic acid, 4-fluoro-, 3-pyridinyl 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 |
217.053906663 u |
| Formula |
C12H8FNO2 |
| InChI |
InChI=1S/C12H8FNO2/c13-10-5-3-9(4-6-10)12(15)16-11-2-1-7-14-8-11/h1-8H |
| InChIKey |
TWUPTGJQENPONL-UHFFFAOYSA-N |
| Molecular Weight |
217.199 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8681 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/9071660; Lab Info: PLU; Lab Number: FCI-5000012 |
