Spektraris NMR
Creolophin C
Common Name: Creolophin C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H16O3/c1-6-4-8-5-14-12(17-14)11(16)7(2)13(14,3)9(8)10(6)15/h4,8-9,11-12,16H,2,5H2,1,3H3/t8-,9+,11-,12-,13+,14-/m1/s1
InChIKey: InChIKey=JRDLQSLNJLZYQK-MBVKLORRSA-N
Formula: C14H16O3
Molecular Weight: 232.275569
Exact Mass: 232.109944
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Opatz, T., Kolshorn, H., Birnbacher, J., Sch¸ffler, A., Deinninger, F., Anke, T. Eur J Org Chem (2007) 0, 5546-50
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Hirsutanes; 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) | 207.8 |
| 2 (CH) | 54.3 |
| 3 (C) | 48.3 |
| 4 (C) | 156.7 |
| 5 (CH) | 73.7 |
| 6 (CH) | 63.7 |
| 7 (C) | 74.8 |
| 8 (CH2) | 27.1 |
| 9 (CH) | 39.8 |
| 10 (CH) | 158.6 |
| 11 (C) | 142.1 |
| 12 (CH3) | 9.9 |
| 14 (CH3) | 15.7 |
| 15 (CH2) | 114.7 |
