Spektraris NMR
7-Hydroxy-10-dehydroxydehydrodihydrobotrydial
Common Name: 7-Hydroxy-10-dehydroxydehydrodihydrobotrydial
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O2/c1-9-5-6-11-12-10(9)7-17-8-15(12,4)13(16)14(11,2)3/h5-6,13,16H,7-8H2,1-4H3/t13-,15-/m1/s1
InChIKey: InChIKey=IRCNNWGKFMKOGI-UKRRQHHQSA-N
Formula: C15H20O2
Molecular Weight: 232.318663
Exact Mass: 232.14633
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) | 129.6 |
| 2 (C) | 131.8 |
| 3 (CH) | 130.6 |
| 4 (CH) | 121.2 |
| 5 (C) | 145.3 |
| 6 (C) | 45.7 |
| 7 (CH) | 85.9 |
| 8 (C) | 44 |
| 9 (C) | 140.9 |
| 10 (CH2) | 65 |
| 11 (CH3) | 19 |
| 12 (CH3) | 24.3 |
| 13 (CH3) | 29 |
| 14 (CH3) | 17.8 |
| 15 (CH2) | 74.9 |
