Spektraris NMR
Dihydrodehydrodiconiferyl alcohol
Common Name: Dihydrodehydrodiconiferyl alcohol
Synonyms: Dihydrodehydrodiconiferyl alcohol
CAS Registry Number:
InChI: InChI=1S/C20H24O6/c1-24-17-10-13(5-6-16(17)23)19-15(11-22)14-8-12(4-3-7-21)9-18(25-2)20(14)26-19/h5-6,8-10,15,19,21-23H,3-4,7,11H2,1-2H3
InChIKey: InChIKey=SBLZVJIHPWRSQQ-UHFFFAOYSA-N
Formula: C20H24O6
Molecular Weight: 360.401726
Exact Mass: 360.157289
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Seca A.M., Silva A.M., Silvestre A.J., Cavaleiro J.A., Domingues F.M., Pascoal-Neto C. Phytochemistry (2001) 56, 759-67
Species:
Notes: Family : Lignans, Type : Neolignans; 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 |
|---|---|
| 2 (CH) | 87.9 |
| 3 (CH) | 53.8 |
| 4 (CH) | 115.9 |
| 5 (C) | 133.1 |
| 6 (CH) | 112.7 |
| 7 (C) | 146.6 |
| 8 (C) | 144.2 |
| 9 (C) | 127.7 |
| 1' (C) | 135.4 |
| 2' (CH) | 108.8 |
| 3' (C) | 146.5 |
| 4' (C) | 145.6 |
| 5' (CH) | 114.2 |
| 6' (CH) | 119.4 |
| 3a (CH2) | 63.9 |
| 5a (CH2) | 32 |
| 5b (CH2) | 34.6 |
| 5c (CH2) | 62.3 |
| 7a (CH3) | 56 |
| 3'a (CH3) | 56 |
