Spektraris NMR
4-Hydroxy-10-epirotundone
Common Name: 4-Hydroxy-10-epirotundone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-9(2)11-6-5-10(3)14-12(7-11)15(4,17)8-13(14)16/h10-11,17H,1,5-8H2,2-4H3/t10-,11-,15-/m1/s1
InChIKey: InChIKey=DMGJIXSDTIWKOG-UEKVPHQBSA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Achenbach, H., Benirschke, G. Phytochemistry (1997) 45, 149-57
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 145.5 |
| 2 (C) | 204.4 |
| 3 (CH2) | 51.4 |
| 4 (C) | 75.8 |
| 5 (C) | 174.4 |
| 6 (CH2) | 28.3 |
| 7 (CH) | 44.5 |
| 8 (CH2) | 28.9 |
| 9 (CH2) | 28.9 |
| 10 (CH) | 28.3 |
| 11 (C) | 149.6 |
| 12 (CH2) | 109.6 |
| 13 (CH3) | 20.1 |
| 14 (CH3) | 17.7 |
| 15 (CH3) | 26.5 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.