Spektraris NMR
(-)-a-Cedrene
Common Name: (-)-a-Cedrene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h7,11-13H,5-6,8-9H2,1-4H3/t11-,12-,13+,15+/m1/s1
InChIKey: InChIKey=IRAQOCYXUMOFCW-CXTNEJHOSA-N
Formula: C15H24
Molecular Weight: 204.351617
Exact Mass: 204.187801
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Brown, G.D., Liang, G.Y., Sy, L.K. Phytochemistry (2003) 64, 303-23
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Cedranes; 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) | 53.9 |
| 2 (CH) | 41.6 |
| 3 (CH2) | 36.2 |
| 4 (CH2) | 24.9 |
| 5 (CH) | 59 |
| 6 (C) | 48.2 |
| 7 (CH) | 55 |
| 8 (C) | 140.6 |
| 9 (CH) | 119.3 |
| 10 (CH2) | 38.8 |
| 11 (CH2) | 40.7 |
| 12 (CH3) | 15.5 |
| 13 (CH3) | 25.6 |
| 14 (CH3) | 27.7 |
| 15 (CH3) | 24.8 |
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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.