Spektraris NMR
7-Hydroxy-10-dehydroxydeacetyldihydrobotrydial-1(10),5(9)-diene
Common Name: 7-Hydroxy-10-dehydroxydeacetyldihydrobotrydial-1(10),5(9)-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-8-5-10(16)12-11-9(8)6-18-7-15(11,4)13(17)14(12,2)3/h6,8,10,13,16-17H,5,7H2,1-4H3/t8-,10+,13-,15-/m1/s1
InChIKey: InChIKey=QSMDCTCUCOLXTM-FMBSFYNOSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
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 (C) | 114.6 |
| 2 (CH) | 24.7 |
| 3 (CH2) | 37 |
| 4 (CH) | 71.6 |
| 5 (C) | 133.5 |
| 6 (C) | 42.3 |
| 7 (CH) | 85.5 |
| 8 (C) | 47 |
| 9 (C) | 135.5 |
| 10 (CH) | 137.6 |
| 11 (CH3) | 16.9 |
| 12 (CH3) | 22.5 |
| 13 (CH3) | 26.4 |
| 14 (CH3) | 15.9 |
| 15 (CH2) | 78.2 |
