Spektraris NMR
(+)-Cascarilladiene
Common Name: (+)-Cascarilladiene
Synonyms: (+)-Cascarilladiene
CAS Registry Number:
InChI: InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h7,10-12H,5-6,8-9H2,1-4H3/t12-,15+/m0/s1
InChIKey: InChIKey=OEJAHQZWKNWZRZ-SWLSCSKDSA-N
Formula: C15H24
Molecular Weight: 204.351617
Exact Mass: 204.187801
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lago J.H., Brochini C.B., Roque N.F. Phytochemistry (2002) 60, 333-8
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 (CH2) | 41.7 |
| 2 (CH2) | 17.6 |
| 3 (CH2) | 31.6 |
| 4 (CH) | 32.9 |
| 5 (C) | 149.6 |
| 6 (CH) | 114.5 |
| 7 (C) | 141.4 |
| 8 (CH) | 120.9 |
| 9 (CH2) | 41.4 |
| 10 (C) | 34.2 |
| 11 (CH) | 35.6 |
| 12 (CH3) | 21.4 |
| 13 (CH3) | 21.8 |
| 14 (CH3) | 23.6 |
| 15 (CH3) | 24.5 |
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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.