Spektraris NMR
15α-Hydroxy-14-aldehyde probotryan-4(5)-ene
Common Name: 15α-Hydroxy-14-aldehyde probotryan-4(5)-ene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-9-4-5-11-13-10(9)6-12(17)15(13,8-16)7-14(11,2)3/h5,8-10,12-13,17H,4,6-7H2,1-3H3/t9-,10+,12?,13+,15+/m1/s1
InChIKey: InChIKey=PDQCQIKOOSJLFX-XMLUMMTISA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Krohn, K., Dai, J., Florke, U., Aust, H.J., Drager, S., Schulz, B. J Nat Prod (2005) 68, 400-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Botryanes; 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 (CH) | 42 |
| 2 (CH) | 34.9 |
| 3 (CH2) | 50.3 |
| 4 (CH) | 136.1 |
| 5 (C) | 151.3 |
| 6 (C) | 50.6 |
| 7 (CH2) | 54 |
| 8 (C) | 58.1 |
| 9 (CH) | 30.7 |
| 10 (CH2) | 41.3 |
| 11 (CH3) | 19.1 |
| 12 (CH3) | 20.2 |
| 13 (CH3) | 31.5 |
| 14 (CH) | 203.4 |
| 15 (CH) | 81.2 |
