Spektraris NMR
Neolitacumone B
Common Name: Neolitacumone B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h11-13,16H,1,4-7H2,2-3H3/t11-,12-,13+,15+/m0/s1
InChIKey: InChIKey=UCBTXCZDWDKENW-RMRHIDDWSA-N
Formula: C15H20O3
Molecular Weight: 248.318068
Exact Mass: 248.141245
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chang, F.R., Hsieh, T.J., Huang, T.L., Chen, C.Y., Kuo, R.Y., Chang, Y.C., Chiu, H.F., Wu, Y.C. J Nat Prod (2002) 65, 255-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 77.6 |
| 2 (CH2) | 30.1 |
| 3 (CH2) | 33.5 |
| 4 (C) | 146.8 |
| 5 (CH) | 47.6 |
| 6 (CH2) | 24.9 |
| 7 (C) | 162.9 |
| 8 (CH) | 78.3 |
| 9 (CH2) | 43.5 |
| 10 (C) | 41.2 |
| 11 (C) | 119.9 |
| 12 (C) | 175.3 |
| 13 (CH3) | 7.8 |
| 14 (CH3) | 10.1 |
| 15 (CH2) | 107.9 |
