Spektraris NMR
Lejeuneapinguisenone
Common Name: Lejeuneapinguisenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-10-5-7-14(3)11(2)12(6-8-16)13(17)9-15(10,14)4/h6,8,10-11H,5,7,9H2,1-4H3/b12-6-/t10-,11-,14+,15+/m1/s1
InChIKey: InChIKey=UTBNMEBYMCRASO-DKLLSWETSA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Lahlou, E.H., Hashimoto, T., Asakawa, Y. Phytochemistry (2000) 53, 271-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Pinguisanes; 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) | 40.7 |
| 2 (CH2) | 35.1 |
| 3 (CH2) | 30 |
| 4 (CH) | 42.7 |
| 5 (C) | 161.3 |
| 6 (C) | 202.1 |
| 7 (CH2) | 49.7 |
| 8 (C) | 50.1 |
| 9 (C) | 48.7 |
| 10 (CH) | 129.7 |
| 11 (CH) | 191.1 |
| 12 (CH3) | 14.5 |
| 13 (CH3) | 18.6 |
| 14 (CH3) | 15.6 |
| 15 (CH3) | 11.4 |
