Spektraris NMR
Nootkaton-12-ol
Common Name: Nootkaton-12-ol
Synonyms: Nootkaton-12-ol
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-10(9-16)12-4-5-13-7-14(17)6-11(2)15(13,3)8-12/h7,10-12,16H,4-6,8-9H2,1-3H3/t10?,11-,12-,15+/m1/s1
InChIKey: InChIKey=AKYDWUWGDODGOE-NABWBXCOSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Han, Y.F., Pan, J., Gao, K., Jia, Z.J. Chem Pharm Bull (2005) 53, 1338-41
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 124.5 |
| 2 (C) | 199.7 |
| 3 (CH2) | 42.1 |
| 4 (CH) | 40.5 |
| 5 (C) | 39.2 |
| 6 (CH2) | 41.3 |
| 7 (CH) | 34.3 |
| 8 (CH2) | 30.7 |
| 9 (CH2) | 33.1 |
| 10 (C) | 171.1 |
| 11 (CH) | 40.2 |
| 12 (CH2) | 65.9 |
| 13 (CH3) | 13.6 |
| 14 (CH3) | 16.9 |
| 15 (CH3) | 15 |
