Spektraris NMR
Dolineone
Common Name: Dolineone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H12O6/c20-19-11-3-9-1-2-21-12(9)5-14(11)25-17-7-22-13-6-16-15(23-8-24-16)4-10(13)18(17)19/h1-6,17-18H,7-8H2/t17-,18+/m0/s1
InChIKey: InChIKey=RAJDDCCSNZAPCH-ZWKOTPCHSA-N
Formula: C19H12O6
Molecular Weight: 336.295701
Exact Mass: 336.063388
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Vanpuyvelde, L., Dekimpe, N., Mudaheranwa, J.P., Gasiga, A., Schamp, N., Declercq, J.P., Vanmeerssche, M. J Nat Prod (1987) 50, 349-56
Species:
Notes: Family : Flavonoids, Type : Rotenoids; 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) | 106.9 |
| 1a (C) | 105.3 |
| 2 (C) | 143.2 |
| 3 (C) | 147.9 |
| 4 (CH) | 98.9 |
| 4a (C) | 148.5 |
| 6 (CH2) | 66.4 |
| 6a (CH) | 72.1 |
| 7a (C) | 159.8 |
| 8 (CH) | 99.8 |
| 9 (C) | 158.6 |
| 10 (C) | 123.1 |
| 11 (CH) | 121 |
| 11a (C) | 116.1 |
| 12 (C) | 190.6 |
| 12a (CH) | 45.3 |
| 1' (CH) | 106.3 |
| 2' (CH) | 145.1 |
| 2a (CH2) | 101.2 |
