Spektraris NMR
Combretastatin D-2
Common Name: Combretastatin D-2
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H16O4/c19-16-9-5-14-6-10-18(20)21-11-1-2-13-3-7-15(8-4-13)22-17(16)12-14/h1-5,7-9,12,19H,6,10-11H2/b2-1-
InChIKey: InChIKey=DTZHRIFDDQELBE-UPHRSURJSA-N
Formula: C18H16O4
Molecular Weight: 296.317918
Exact Mass: 296.104859
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Singh.B., Pettit, G.R. J Org Chem (1990) 55, 2797-800
Species:
Notes: Family : Aromatics, Type : Biphenyl-ethers, Group : Macrolactone-Diphenyl-ethers; 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 |
|---|---|
| 2 (CH2) | 59.06 |
| 3 (CH) | 137.74 |
| 4 (CH) | 135.45 |
| 5 (C) | 132.01 |
| 6 (CH) | 129.09 |
| 7 (CH) | 123.89 |
| 8 (C) | 155.6 |
| 10 (C) | 149.32 |
| 11 (C) | 142.48 |
| 12 (CH) | 115.39 |
| 13 (CH) | 121.89 |
| 14 (C) | 131.14 |
| 15 (CH2) | 26.89 |
| 16 (CH2) | 32.42 |
| 17 (C) | 173.3 |
| 18 (CH) | 125.68 |
| 19 (CH) | 123.89 |
| 20 (CH) | 112.58 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.