Spektraris NMR
3,3',5-Trimethoxybibenzyl
Common Name: 3,3',5-Trimethoxybibenzyl
Synonyms: 3,3',5-Trimethoxybibenzyl
CAS Registry Number:
InChI: InChI=1S/C17H20O3/c1-18-15-6-4-5-13(9-15)7-8-14-10-16(19-2)12-17(11-14)20-3/h4-6,9-12H,7-8H2,1-3H3
InChIKey: InChIKey=JKLWPFRFUHSWOA-UHFFFAOYSA-N
Formula: C17H20O3
Molecular Weight: 272.33954
Exact Mass: 272.141245
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hernandez-Romero, Y., Rojas, J.I., Castillo, R., Rojas, A., Mata, R. J Nat Prod (2004) 67, 160-7
Species:
Notes: Family : Aromatics, Type : Stilbenes, Group : Stilbenes; 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) | 143.2 |
| 2 (CH) | 114.1 |
| 3 (C) | 159.5 |
| 4 (CH) | 111.2 |
| 5 (CH) | 129.2 |
| 6 (CH) | 120.7 |
| α (CH2) | 37.8 |
| β (CH2) | 38.2 |
| 1' (C) | 144 |
| 2' (CH) | 106.4 |
| 3' (C) | 160.6 |
| 4' (CH) | 97.9 |
| 5' (C) | 160.6 |
| 6' (CH) | 106.4 |
| 3a (CH3) | 55.1 |
| 3'b (CH3) | 55.2 |
| 5'a (CH3) | 55.2 |
