Spektraris NMR
Xylarenone A
Common Name: Xylarenone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O4/c1-8-4-5-11(17)10-6-12(18)15(9(2)7-16)13(19-15)14(8,10)3/h6,8,11,13,16-17H,2,4-5,7H2,1,3H3/t8-,11+,13+,14+,15-/m0/s1
InChIKey: InChIKey=PSGJCHLXOJTCGB-SXHPEXCUSA-N
Formula: C15H20O4
Molecular Weight: 264.317473
Exact Mass: 264.136159
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hu, Z.Y., Li, Y.Y., Huang, Y.J., Su, W.J., Shen, Y.M. Helv Chim Acta (2008) 91, 46-52
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 (CH) | 73.2 |
| 2 (CH2) | 32.9 |
| 3 (CH2) | 24.4 |
| 4 (CH) | 37.7 |
| 5 (C) | 40.1 |
| 6 (CH) | 69.6 |
| 7 (C) | 62.9 |
| 8 (C) | 195.4 |
| 9 (CH) | 123 |
| 10 (C) | 164.2 |
| 11 (C) | 142.7 |
| 12 (CH2) | 115.6 |
| 13 (CH2) | 63.5 |
| 14 (CH3) | 19.1 |
| 15 (CH3) | 15.8 |
