Spektraris NMR
caryophyllenol-II
Common Name: caryophyllenol-II
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h5,12-14,16H,1,6-9H2,2-4H3/b11-5-/t12-,13-,14+/m0/s1
InChIKey: InChIKey=DWUYGFWOANEJRE-LJQZHBTOSA-N
Formula: C15H24O1
Molecular Weight: 220.351021
Exact Mass: 220.182715
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Li, Y., Huang, H., Guo, Y.W. Nat Prod Res (2008) 22, 1359-64
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Caryophyllanes; 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 (CH) | 50.3 |
| 2 (CH2) | 28.6 |
| 3 (CH) | 125.9 |
| 4 (C) | 138 |
| 5 (CH) | 69.7 |
| 6 (CH2) | 34.3 |
| 7 (CH2) | 32.5 |
| 8 (C) | 154.6 |
| 9 (CH) | 42.5 |
| 10 (CH2) | 39.7 |
| 11 (C) | 33.2 |
| 12 (CH3) | 22.8 |
| 13 (CH3) | 30 |
| 14 (CH3) | 15.6 |
| 15 (CH2) | 109.7 |
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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.