Spektraris NMR
Eremofarfugin C
Common Name: Eremofarfugin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-8-5-4-6-10-7-11-12(9(2)14(17)18-11)13(16)15(8,10)3/h8-10,13,16H,4-7H2,1-3H3/t8-,9+,10+,13+,15+/m0/s1
InChIKey: InChIKey=VMUFDWQSKQTRRF-MNUQXQRLSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Tori, M., Watanabe, A., Matsuo, S., Okamoto, Y., Tachikawa, K., Takaoka, S., Gong, X., Kuroda, C., Hanai, R. Tetrahedron (2008) 64, 4486-95
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 27.3 |
| 2 (CH2) | 20.5 |
| 3 (CH2) | 29.7 |
| 4 (CH) | 31.4 |
| 5 (C) | 40.4 |
| 6 (CH) | 66.7 |
| 7 (C) | 116.4 |
| 8 (C) | 149.6 |
| 9 (CH2) | 25.3 |
| 10 (CH) | 35.1 |
| 11 (CH) | 39 |
| 12 (C) | 180 |
| 13 (CH3) | 14.2 |
| 14 (CH3) | 17.3 |
| 15 (CH3) | 15 |
