Spektraris NMR
Eduenone
Common Name: Eduenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O/c1-14(2)17-11-12-20(5)18(17)10-9-15(3)7-6-8-16(4)13-19(20)21/h7,13,18H,6,8-12H2,1-5H3/b15-7-,16-13-/t18-,20-/m1/s1
InChIKey: InChIKey=UPOREMYWIBIKTQ-DJIMEFRCSA-N
Formula: C20H30O1
Molecular Weight: 286.452345
Exact Mass: 286.229666
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, A.D., Gonzalez, E., Gonzalez, C. J Nat Prod (1995) 58, 226-32
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Dolabellanes; 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 (C) | 57.55 |
| 2 (C) | 209.54 |
| 3 (CH) | 122.03 |
| 4 (C) | 152.97 |
| 5 (CH2) | 32.07 |
| 6 (CH2) | 22.47 |
| 7 (CH) | 125.21 |
| 8 (C) | 134.88 |
| 9 (CH2) | 29.07 |
| 10 (CH2) | 26.28 |
| 11 (CH) | 45.97 |
| 12 (C) | 139.23 |
| 13 (CH2) | 30.88 |
| 14 (CH2) | 39.22 |
| 15 (CH3) | 16.64 |
| 16 (CH3) | 29.89 |
| 17 (CH3) | 20.92 |
| 18 (C) | 122.76 |
| 19 (CH3) | 22.91 |
| 20 (CH3) | 22.91 |
