Spektraris NMR
Martiusane
Common Name: Martiusane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-13(2)14-10-17(22)19(11-15(14)21)9-6-16-18(3,4)7-5-8-20(16,23)12-19/h10,13,16,23H,5-9,11-12H2,1-4H3/t16-,19?,20-/m0/s1
InChIKey: InChIKey=ZDSPQKVEIYKDSC-LIXNJBPUSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - da Cruz Araujo, E.C., Lima, M.A., Silveira, E.R. Magn Reson Chem (2004) 42, 1049-52
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) | 41.8 |
| 2 (CH2) | 17.8 |
| 3 (CH2) | 42.1 |
| 4 (C) | 33.2 |
| 5 (CH) | 51.9 |
| 6 (CH2) | 18 |
| 7 (CH2) | 35.3 |
| 8 (CH2) | 48.6 |
| 9 (C) | 50.7 |
| 10 (C) | 72.6 |
| 11 (C) | 204.2 |
| 12 (CH) | 133.2 |
| 13 (C) | 159.4 |
| 14 (C) | 199.7 |
| 15 (CH) | 27.2 |
| 16 (CH3) | 21.6 |
| 17 (CH3) | 21.5 |
| 18 (CH3) | 32.6 |
| 19 (CH3) | 21.9 |
| 20 (CH2) | 46.8 |
