Spektraris NMR
Furanoeremophilan-4β,6α-olide
Common Name: Furanoeremophilan-4β,6α-olide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O3/c1-8-7-17-11-6-9-4-3-5-10-14(16)18-13(12(8)11)15(9,10)2/h7,9-10,13H,3-6H2,1-2H3/t9-,10-,13+,15+/m1/s1
InChIKey: InChIKey=KTALFCIOJDCGJF-NRWDQBFYSA-N
Formula: C15H18O3
Molecular Weight: 246.302187
Exact Mass: 246.125594
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Xue, H.Q., Ma, X.M., Xing, X.L., Wang, H.Q. Chem Nat Compd (2007) 43, 746-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 20.48 |
| 2 (CH2) | 18.74 |
| 3 (CH2) | 23.14 |
| 4 (CH) | 41.27 |
| 5 (C) | 41.42 |
| 6 (CH) | 81.63 |
| 7 (C) | 120.08 |
| 8 (C) | 150.78 |
| 9 (CH2) | 25.24 |
| 10 (CH) | 36.95 |
| 11 (C) | 114.68 |
| 12 (CH) | 138.56 |
| 13 (CH3) | 8.24 |
| 14 (CH3) | 20.3 |
| 15 (C) | 176.65 |
