Spektraris NMR
(+)-Secolongifolene diol
Common Name: (+)-Secolongifolene diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O2/c1-14(2)6-4-7-15(3)11(10-17)9-13(14)12(15)5-8-16/h9,12-13,16-17H,4-8,10H2,1-3H3/t12-,13+,15-/m0/s1
InChIKey: InChIKey=RYUMBZJZMMNHTP-GUTXKFCHSA-N
Formula: C15H26O2
Molecular Weight: 238.366308
Exact Mass: 238.19328
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Osterhage, C., Konig, G.M., Holler, U., Wright, A.D. J Nat Prod (2002) 65, 306-13
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Longifolanes; 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) | 128.3 |
| 2 (C) | 147.9 |
| 3 (C) | 51.4 |
| 4 (CH2) | 45.7 |
| 5 (CH2) | 22.1 |
| 6 (CH2) | 42.7 |
| 7 (CH) | 36.7 |
| 8 (CH3) | 21.8 |
| 9 (C) | 58.9 |
| 10 (CH3) | 32.5 |
| 11 (CH3) | 27.9 |
| 12 (CH2) | 59.7 |
| 13 (CH) | 47 |
| 14 (CH2) | 35.2 |
| 15 (CH2) | 62.1 |
