Spektraris NMR
3-Epi-perforenone A
Common Name: 3-Epi-perforenone A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-9-5-6-12-10(2)13(16)14(17)11(3)15(12,4)8-7-9/h7,11,14,17H,5-6,8H2,1-4H3/t11-,14+,15+/m0/s1
InChIKey: InChIKey=FUPXAIKSURJKNB-NILFDRSVSA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wright, A.D., Goclik, E., Konig, G.M. J Nat Prod (2003) 66, 435-7
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Perforanes; 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) | 125.6 |
| 2 (C) | 200.1 |
| 3 (CH) | 72.7 |
| 4 (CH) | 46.2 |
| 5 (C) | 44.1 |
| 6 (CH2) | 39 |
| 7 (CH) | 121.6 |
| 8 (C) | 138.1 |
| 9 (CH2) | 33 |
| 10 (CH2) | 27.4 |
| 11 (C) | 165.9 |
| 12 (CH3) | 10.9 |
| 13 (CH3) | 9.1 |
| 14 (CH3) | 24.2 |
| 15 (CH3) | 26.6 |
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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.