Spektraris NMR
Barekoxide
Common Name: Barekoxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O/c1-17(2)9-6-10-19(4)14(17)7-11-18(3)13-16-20(5,21-16)12-8-15(18)19/h14-16H,6-13H2,1-5H3/t14-,15-,16+,18-,19-,20-/m0/s1
InChIKey: InChIKey=XLDXFKILDJRZEE-UXTPAWKISA-N
Formula: C20H34O1
Molecular Weight: 290.484108
Exact Mass: 290.260966
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Kuniyoshi, M., Marma, M.S., Higa, T., Bernardinelli, G., Jefford, C.W. J Nat Prod (2001) 64, 696-700
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Laukarlanes; 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) | 40.27 |
| 2 (CH2) | 19.16 |
| 3 (CH2) | 42.11 |
| 4 (C) | 33.57 |
| 5 (CH) | 56.26 |
| 6 (CH2) | 18.85 |
| 7 (CH2) | 44.23 |
| 8 (C) | 37.74 |
| 9 (CH) | 64.51 |
| 10 (C) | 38.96 |
| 11 (CH2) | 20.38 |
| 12 (CH2) | 36.64 |
| 13 (C) | 59.87 |
| 14 (CH) | 60.02 |
| 15 (CH2) | 47.99 |
| 16 (CH3) | 22.7 |
| 17 (CH3) | 19.79 |
| 18 (CH3) | 33.57 |
| 19 (CH3) | 21.77 |
| 20 (CH3) | 16.2 |
