| SpectraBase Spectrum ID |
qjcKEFPqvC |
| Name |
benzenebutanoic acid, alpha-hydroxy-gamma-oxo-alpha-(trifluoromethyl)-, ethyl ester |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.076593384 u |
| Formula |
C13H13F3O4 |
| InChI |
InChI=1S/C13H13F3O4/c1-2-20-11(18)12(19,13(14,15)16)8-10(17)9-6-4-3-5-7-9/h3-7,19H,2,8H2,1H3 |
| InChIKey |
NKFNWRRECOIYEH-UHFFFAOYSA-N |
| Molecular Weight |
290.238 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7773 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10231177; Lab Info: AU; Lab Number: AU-ME00674 |
| Temperature |
23.85 °C |
