Spektraris NMR
Isodysetherin
Common Name: Isodysetherin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O3/c1-8-4-5-10-9(6-8)7-15(14(10,2)3)11-12(17-11)18-13(15)16/h6,9-12H,4-5,7H2,1-3H3/t9-,10-,11-,12-,15+/m0/s1
InChIKey: InChIKey=ZBRIBJZHIFOMAV-IAGXKZSMSA-N
Formula: C15H20O3
Molecular Weight: 248.318068
Exact Mass: 248.141245
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Huang, X.C., Li, J., Li, Z.Y., Shi, L., Guo, Y.W. J Nat Prod (2008) 71, 1399-403
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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) | 48.4 |
| 2 (C) | 58.6 |
| 3 (CH2) | 41.9 |
| 4 (CH) | 38.5 |
| 5 (CH) | 121.8 |
| 6 (C) | 135.4 |
| 7 (CH2) | 30.4 |
| 8 (CH2) | 20.9 |
| 9 (CH) | 51 |
| 10 (CH3) | 29.1 |
| 11 (CH3) | 22.4 |
| 12 (CH) | 59.2 |
| 13 (CH) | 77.9 |
| 14 (C) | 179.1 |
| 15 (CH3) | 23.6 |
