Spektraris NMR
3-(15)-Thujopsen-10a-ol
Common Name: 3-(15)-Thujopsen-10a-ol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O/c1-10-5-7-14(4)8-6-12(16)13(2,3)15(14)9-11(10)15/h11-12,16H,1,5-9H2,2-4H3/t11-,12-,14+,15-/m1/s1
InChIKey: InChIKey=STQUAQUHGIVESS-RJZRQDKASA-N
Formula: C15H24O1
Molecular Weight: 220.351021
Exact Mass: 220.182715
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Toyota, M., Konoshima, M., Yoshinori, A. Phytochemistry (1999) 52, 105-12
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Thujopsanes; 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) | 17.3 |
| 2 (CH) | 27.6 |
| 3 (C) | 154 |
| 4 (CH2) | 29.6 |
| 5 (CH2) | 28.8 |
| 6 (C) | 46.2 |
| 7 (C) | 38 |
| 8 (CH2) | 30 |
| 9 (CH2) | 29.3 |
| 10 (CH) | 80.4 |
| 11 (C) | 47.1 |
| 12 (CH3) | 17.4 |
| 13 (CH3) | 22.3 |
| 14 (CH3) | 22.6 |
| 15 (CH2) | 101.7 |
