Spektraris NMR
Uralstilbene
Common Name: Uralstilbene
Synonyms: Uralstilbene
CAS Registry Number:
InChI: InChI=1S/C24H30O4/c1-16(2)5-9-21-19(8-6-18-7-10-22(26)23(27)13-18)14-20(25)15-24(21)28-12-11-17(3)4/h5,7,10-11,13-15,25-27H,6,8-9,12H2,1-4H3
InChIKey: InChIKey=BNTYXDBRBRYHOP-UHFFFAOYSA-N
Formula: C24H30O4
Molecular Weight: 382.493504
Exact Mass: 382.214409
NMR Solvent:
MHz:
Calibration:
NMR references: 13C - Biondi, D.M., Rocco, C., Ruberto, G. J Nat Prod (2005) 68, 1099-102
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) | 118 |
| 2 (C) | 141.3 |
| 3 (C) | 157.1 |
| 4 (CH) | 98.1 |
| 5 (C) | 155.9 |
| 6 (CH) | 107.9 |
| α (CH2) | 35.1 |
| β (CH2) | 36.5 |
| 1' (C) | 132.7 |
| 2' (CH) | 115.6 |
| 3' (C) | 145 |
| 4' (C) | 143.2 |
| 5' (CH) | 115.5 |
| 6' (CH) | 118.8 |
| 1'' (CH2) | 24 |
| 2'' (CH) | 124.4 |
| 3'' (C) | 129.2 |
| 4'' (CH3) | 17.9 |
| 5'' (CH3) | 25.4 |
| 3a (CH2) | 64.5 |
| 3b (CH) | 120.4 |
| 3c (C) | 136.4 |
| 3d (CH3) | 17.9 |
| 3e (CH3) | 25.5 |
