Spektraris NMR
Ferulic acid
Common Name: Ferulic acid
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H26O3Si2/c1-18-15-12-13(9-11-16(17)20(2,3)4)8-10-14(15)19-21(5,6)7/h8-12H,1-7H3/b11-9+
InChIKey: InChIKey=OPZMYOPABANOKL-PKNBQFBNSA-N
Formula: C16H26O3S2
Molecular Weight: 330.508618
Exact Mass: 330.132336
NMR Solvent:
MHz:
Calibration:
NMR references: 13C - Schraml, J., Blechta, V., Sykora, J., Soukupova, L., Curinova, P., Pronek, D., Lachman, J. Magn Reson Chem (2005) 43, 829-34
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) | 128.23 |
| 2 (CH) | 122.02 |
| 3 (C) | 150.82 |
| 4 (C) | 146.76 |
| 5 (CH) | 120.8 |
| 6 (CH) | 110.59 |
| 7 (CH) | 145.05 |
| 8 (CH) | 117.46 |
| 9 (C) | 166.91 |
| 3a (CH3) | 55.12 |
| 4a (CH3) | 0.38 |
| 4b (CH3) | 0.38 |
| 4c (CH3) | 0.38 |
| 9a (CH3) | 0.12 |
| 9b (CH3) | 0.12 |
| 9c (CH3) | 0.12 |
