Spektraris NMR
11-Hydroxy-valenc-1(10)-en-2-one
Common Name: 11-Hydroxy-valenc-1(10)-en-2-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-10-7-13(16)8-11-5-6-12(14(2,3)17)9-15(10,11)4/h8,10,12,17H,5-7,9H2,1-4H3/t10-,12-,15+/m1/s1
InChIKey: InChIKey=OVISDQKZYWLLLK-HCKVZZMMSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Savona, G., Piozzi, F., Torre, M.C.d.l., Servettaz, O., Rodriguez, B. Phytochemistry (1987) 26, 571-2
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) | 124.2 |
| 2 (C) | 199.9 |
| 3 (CH2) | 42 |
| 4 (CH) | 40.5 |
| 5 (C) | 39.1 |
| 6 (CH2) | 39.6 |
| 7 (CH) | 43.8 |
| 8 (CH2) | 27.7 |
| 9 (CH2) | 33 |
| 10 (C) | 171.6 |
| 11 (C) | 72 |
| 12 (CH3) | 27.2 |
| 13 (CH3) | 26.8 |
| 14 (CH3) | 16.9 |
| 15 (CH3) | 14.9 |
