Spektraris NMR
Canusesnol J
Common Name: Canusesnol J
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-10(8-16)12-3-4-15(7-12)11(2)5-14(18)6-13(15)9-17/h6,11-12,16-17H,1,3-5,7-9H2,2H3/t11-,12+,15-/m1/s1
InChIKey: InChIKey=FAZOKTVSMLHHMC-TYNCELHUSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Kawaguchi, Y., Ochi, T., Takaishi, Y., Kawazoe, K., Lee, K.H. J Nat Prod (2004) 67, 1893-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Spirovetivanes; 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) | 121.9 |
| 2 (C) | 202.1 |
| 3 (CH2) | 43.9 |
| 4 (CH) | 40.6 |
| 5 (C) | 50.2 |
| 6 (CH2) | 42.7 |
| 7 (CH) | 43.5 |
| 8 (CH2) | 34.5 |
| 9 (CH2) | 34 |
| 10 (C) | 172.4 |
| 11 (C) | 152.5 |
| 12 (CH2) | 108.4 |
| 13 (CH2) | 65.8 |
| 14 (CH2) | 61.8 |
| 15 (CH3) | 16.1 |
