Spektraris NMR
Jamesoniellide E
Common Name: Jamesoniellide E
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H22O6/c1-19(13-8-14(24-18(13)22)11-6-7-23-10-11)9-16-20(2)12(17(21)25-16)4-3-5-15(20)26-19/h4,6-7,10,13-16H,3,5,8-9H2,1-2H3/t13?,14-,15-,16-,19-,20+/m0/s1
InChIKey: InChIKey=JJVFOXGGNFRVFV-HCBQFAAWSA-N
Formula: C20H22O6
Molecular Weight: 358.385844
Exact Mass: 358.141638
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Tazaki, H., Zapp, J., Becker, H. Phytochemistry (1995) 39, 859-68
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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) | 23.3 |
| 2 (CH2) | 21.5 |
| 3 (CH) | 136.5 |
| 4 (C) | 130 |
| 5 (C) | 38.5 |
| 6 (CH) | 80.1 |
| 7 (CH2) | 34.4 |
| 8 (C) | 73.8 |
| 9 (CH) | 49.7 |
| 10 (CH) | 68.5 |
| 11 (CH2) | 30.8 |
| 12 (CH) | 72.8 |
| 13 (C) | 124.9 |
| 14 (CH) | 108.2 |
| 15 (CH) | 144 |
| 16 (CH) | 139.5 |
| 17 (CH3) | 20.2 |
| 18 (C) | 169.3 |
| 19 (CH3) | 24.2 |
| 20 (C) | 174.8 |
