Spektraris NMR
4-Hydroxy-3-methoxyphenyl ferulate
Common Name: 4-Hydroxy-3-methoxyphenyl ferulate
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H16O6/c1-21-15-9-11(3-6-13(15)18)4-8-17(20)23-12-5-7-14(19)16(10-12)22-2/h3-10,18-19H,1-2H3/b8-4+
InChIKey: InChIKey=KAMQVZPXKHTIES-XBXARRHUSA-N
Formula: C17H16O6
Molecular Weight: 316.305992
Exact Mass: 316.094688
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wilairat, R., Manosroi, J., Manosroi, A., Kijjoa, A., Nascimento, M.S., Pinto, M., Silva, A.M., Eaton, G., Herz, W. Planta Med (2005) 71, 680-2
Species:
Notes: Family : Aromatics, Type : Phenyl-alkanoids, Group : Phenylpropanoids; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (C) | 126.81 |
| 2 (CH) | 109.42 |
| 3 (C) | 146.76 |
| 4 (C) | 148.05 |
| 5 (CH) | 114.72 |
| 6 (CH) | 123.09 |
| 7 (CH) | 145.17 |
| 8 (CH) | 115.15 |
| 9 (C) | 167.28 |
| 1' (C) | 131.68 |
| 2' (CH) | 111.22 |
| 3' (C) | 146.43 |
| 4' (C) | 143.87 |
| 5' (CH) | 114.13 |
| 6' (CH) | 121.71 |
| 3a (CH3) | 55.96 |
| 3'a (CH3) | 55.73 |
