Spektraris NMR
Sclareol glycol
Common Name: Sclareol glycol
Synonyms: Sclareol glycol
CAS Registry Number:
InChI: InChI=1S/C16H30O2/c1-14(2)8-5-9-15(3)12(14)6-10-16(4,18)13(15)7-11-17/h12-13,17-18H,5-11H2,1-4H3/t12-,13+,15-,16+/m0/s1
InChIKey: InChIKey=AIALTZSQORJYNJ-LQKXBSAESA-N
Formula: C16H30O2
Molecular Weight: 254.408807
Exact Mass: 254.22458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bastard, J., Duc, D.K., Fetizon, M., Francis, M.J., Grant, P.K., Weavers, R.T., Kaneko, C., Baddeley, G.V., Bernassau, J.M., Burfitt, I.R., Wovkulich, P.M., Wenkert, E. J Nat Prod (1984) 47, 592-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 39.5 |
| 2 (CH2) | 18.4 |
| 3 (CH2) | 42 |
| 4 (C) | 33.3 |
| 5 (CH) | 56.1 |
| 6 (CH2) | 20.5 |
| 7 (CH2) | 44.3 |
| 8 (C) | 73 |
| 9 (CH) | 59.2 |
| 10 (C) | 39 |
| 11 (CH2) | 28 |
| 12 (CH2) | 64.1 |
| 17 (CH3) | 24.6 |
| 18 (CH3) | 33.4 |
| 19 (CH3) | 21.5 |
| 20 (CH3) | 15.3 |
