Spektraris NMR
4,5-Dihydro-7α-Hydroxyfrullanolide
Common Name: 4,5-Dihydro-7α-Hydroxyfrullanolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-9-5-4-6-14(3)7-8-15(17)10(2)13(16)18-12(15)11(9)14/h9,11-12,17H,2,4-8H2,1,3H3/t9-,11+,12-,14+,15+/m0/s1
InChIKey: InChIKey=REKMTRHNGZNMJQ-PISGWYDKSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Aquil, S., Husaini, A.M., Abdin, M.Z., Rather, G.M. Planta Med (2009) 75, 1453-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 38.9 |
| 2 (CH2) | 28.2 |
| 3 (CH2) | 33.1 |
| 4 (CH) | 49.8 |
| 5 (CH) | 50.1 |
| 6 (CH) | 80 |
| 7 (C) | 75.4 |
| 8 (CH2) | 29.8 |
| 9 (CH2) | 35 |
| 10 (C) | 33.1 |
| 11 (C) | 144.5 |
| 12 (C) | 169 |
| 13 (CH2) | 121 |
| 14 (CH3) | 19.4 |
| 15 (CH3) | 10.8 |
