Spektraris NMR
1beta-Hydroxytorilolone
Common Name: 1beta-Hydroxytorilolone
Synonyms: 1beta-Hydroxytorilolone
CAS Registry Number:
InChI: InChI=1S/C15H24O4/c1-8-5-12(16)11(14(3,4)18)6-10-9(2)13(17)7-15(8,10)19/h8,11-12,16,18-19H,5-7H2,1-4H3/t8-,11-,12+,15-/m0/s1
InChIKey: InChIKey=BMNVAUVOOUYDDR-VCJARVCASA-N
Formula: C15H24O4
Molecular Weight: 268.349236
Exact Mass: 268.167459
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Yi, T., Zhang, L., Fu, H.W., Yang, S.L., Tian, J.K. Helv Chim Acta (2009) 92, 2769-73
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 80.4 |
| 2 (CH2) | 50.7 |
| 3 (C) | 209.9 |
| 4 (C) | 135.5 |
| 5 (C) | 178.2 |
| 6 (CH2) | 23 |
| 7 (CH) | 51.3 |
| 8 (CH) | 71.3 |
| 9 (CH2) | 39.7 |
| 10 (CH) | 39.1 |
| 11 (C) | 74.8 |
| 12 (CH3) | 28.9 |
| 13 (CH3) | 28.5 |
| 14 (CH3) | 19.1 |
| 15 (CH3) | 8.1 |
