Spektraris NMR
Fascicularone K
Common Name: Fascicularone K
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O5/c1-6-10-9(17)11(18)14(5-16)7-4-13(2,3)8(7)12(20-10)15(6,14)19/h6-10,12,16-17,19H,4-5H2,1-3H3/t6-,7+,8-,9+,10+,12+,14+,15-/m1/s1
InChIKey: InChIKey=LCSYZQCFYXMVAL-VFJQALHXSA-N
Formula: C15H22O5
Molecular Weight: 282.33276
Exact Mass: 282.146724
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Akasaka, F., Shiono, Y., Murayama, T., Ikeda, M. Helv Chim Acta (2005) 88, 2944-50
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, 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 (CH) | 54.5 |
| 2 (CH) | 89.3 |
| 3 (C) | 91.9 |
| 4 (CH) | 45.6 |
| 5 (CH) | 85.4 |
| 6 (CH) | 80.8 |
| 7 (C) | 219.6 |
| 8 (C) | 71.9 |
| 9 (CH) | 45.2 |
| 10 (CH2) | 35.9 |
| 11 (C) | 35.4 |
| 12 (CH3) | 33.6 |
| 13 (CH3) | 25.4 |
| 14 (CH3) | 15.2 |
| 15 (CH2) | 63.3 |
