Spektraris NMR
Phylloclad-15-ene-3,17-dione
Common Name: Phylloclad-15-ene-3,17-dione
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O2/c1-18(2)15-6-9-20-10-13(14(11-20)12-21)4-5-16(20)19(15,3)8-7-17(18)22/h11-13,15-16H,4-10H2,1-3H3/t13-,15+,16-,19+,20+/m1/s1
InChIKey: InChIKey=KTTWFPGCPBDNGC-OPLZCHAUSA-N
Formula: C20H28O2
Molecular Weight: 300.435869
Exact Mass: 300.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shao, Y., Hu, L.H., Sim, K.Y., Goh, S.H. Helv Chim Acta (2006) 89, 64-72
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Phyllocladanes; 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 (CH2) | 37.42 |
| 2 (CH2) | 34.31 |
| 3 (C) | 216.62 |
| 4 (C) | 47.61 |
| 5 (CH) | 55.52 |
| 6 (CH2) | 20.85 |
| 7 (CH2) | 35.58 |
| 8 (C) | 49.46 |
| 9 (CH) | 52.98 |
| 10 (C) | 36.96 |
| 11 (CH2) | 19.14 |
| 12 (CH2) | 24.43 |
| 13 (CH) | 36.96 |
| 14 (CH2) | 53.65 |
| 15 (CH) | 155.57 |
| 16 (C) | 147.35 |
| 17 (CH) | 189.65 |
| 18 (CH3) | 26.14 |
| 19 (CH3) | 21.87 |
| 20 (CH3) | 15.07 |
