Spektraris NMR
Annuionone F
Common Name: Annuionone F
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C13H22O4/c1-9-6-11(16)7-12(3,8-14)13(9,17)5-4-10(2)15/h4-5,9-10,14-15,17H,6-8H2,1-3H3/b5-4+/t9-,10-,12-,13-/m1/s1
InChIKey: InChIKey=RLKZNMMKYFJAPM-UVJNOFBYSA-N
Formula: C13H22O4
Molecular Weight: 242.311883
Exact Mass: 242.151809
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Macias, F.A., Lopez, A., Varela, R.M., Torres, A., Molinillo, J.M. Phytochemistry (2004) 65, 3057-63
Species:
Notes: Family : Terpenoids, Type : Miscellanea, Group : Megastigmanes; 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) | 45 |
| 2 (CH2) | 46.6 |
| 3 (C) | 211.7 |
| 4 (CH2) | 45.2 |
| 5 (CH) | 37 |
| 6 (C) | 78.3 |
| 7 (CH) | 131.5 |
| 8 (CH) | 135.7 |
| 9 (CH) | 68.7 |
| 10 (CH3) | 24.1 |
| 11 (CH3) | 15.1 |
| 12 (CH3) | 19.7 |
| 13 (CH2) | 70 |
