Spektraris NMR
Illudiolone
Common Name: Illudiolone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O3/c1-13(8-16)6-9-10(7-13)14(2)5-4-11(14)15(3,18)12(9)17/h9-11,16,18H,4-8H2,1-3H3/t9-,10-,11+,13+,14+,15+/m0/s1
InChIKey: InChIKey=HSASJPCIWZMQPM-PAUVFPHUSA-N
Formula: C15H24O3
Molecular Weight: 252.349831
Exact Mass: 252.172545
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - McMorris T.C., Kashinatham A., Lira R., Rundgren H., Gantzel P.K., Kelner M.J., Dawe R. Phytochemistry (2002) 61, 395-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Protoilludanes; 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) | 37.2 |
| 2 (CH) | 54 |
| 3 (C) | 40.4 |
| 4 (CH2) | 29.7 |
| 5 (CH2) | 19.7 |
| 6 (CH) | 58.5 |
| 7 (C) | 77.1 |
| 8 (C) | 214.7 |
| 9 (CH) | 46.3 |
| 10 (CH2) | 33.6 |
| 11 (C) | 42.6 |
| 12 (CH2) | 71.3 |
| 13 (CH3) | 26.8 |
| 14 (CH3) | 28.5 |
| 15 (CH3) | 22.2 |
