Spektraris NMR
3α-hydroxy-11βH-eudesm-5-en-8β,12-olide
Common Name: 3α-hydroxy-11βH-eudesm-5-en-8β,12-olide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-8-10-6-11-9(2)12(16)4-5-15(11,3)7-13(10)18-14(8)17/h6,8-10,12-13,16H,4-5,7H2,1-3H3/t8-,9-,10-,12-,13-,15-/m1/s1
InChIKey: InChIKey=YYFKBQHEOQEXAG-HZPQVJCSSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - Ma, X.C., Liu, K.X., Zhang, B.J., Xin, X.L., Huang, J. Magn Reson Chem (2008) 46, 1084-8
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) | 34.5 |
| 2 (CH2) | 23.8 |
| 3 (CH) | 70.4 |
| 4 (CH) | 45.5 |
| 5 (C) | 145.2 |
| 6 (CH) | 122.2 |
| 7 (CH) | 41.8 |
| 8 (CH) | 76.2 |
| 9 (CH2) | 41.9 |
| 10 (C) | 32.3 |
| 11 (CH) | 43.1 |
| 12 (C) | 179.5 |
| 13 (CH3) | 15.8 |
| 14 (CH3) | 28.8 |
| 15 (CH3) | 21.1 |
