Spektraris NMR
(6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-6,14-hexadecadiene-4-one
Common Name: (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-6,14-hexadecadiene-4-one
Synonyms: (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-6,14-hexadecadiene-4-one
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-15(2)13-19(22)14-17(4)7-6-8-18(5)20(23)10-9-16(3)11-12-21/h7,11,15,20-21,23H,5-6,8-10,12-14H2,1-4H3/b16-11+,17-7+
InChIKey: InChIKey=VKHDETPVJBOHTK-UPVCKODDSA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ortalo-Magne, A., Culioli, G., Valls, R., Pucci, B., Piovetti, L. Phytochemistry (2005) 66, 2316-23
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phytanes; 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 (CH2) | 59.3 |
| 2 (CH) | 123.6 |
| 3 (C) | 139.3 |
| 4 (CH2) | 35.6 |
| 5 (CH2) | 33.3 |
| 6 (CH) | 74.9 |
| 7 (C) | 151.3 |
| 8 (CH2) | 30.8 |
| 9 (CH2) | 26.6 |
| 10 (CH) | 129.1 |
| 11 (C) | 129.6 |
| 12 (CH2) | 54.2 |
| 13 (C) | 209.7 |
| 14 (CH2) | 50.8 |
| 15 (CH) | 24.4 |
| 16 (CH3) | 22.5 |
| 17 (CH3) | 22.5 |
| 18 (CH3) | 16.5 |
| 19 (CH2) | 110.1 |
| 20 (CH3) | 16.3 |
