Spektraris NMR
Common Name:
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H14O6/c1-21-13-8-14(22-2)17-15(16(13)20)11(19)7-12(23-17)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3
InChIKey: InChIKey=QNJZBZHPTVYGFA-UHFFFAOYSA-N
Formula: C17H14O6
Molecular Weight: 314.29011
Exact Mass: 314.079038
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - M. linuma, S. Matsuura Yakugaku Zasshi (1900) 100, 657
Species:
Notes: Family : Flavonoids, Type : Flavonoids, Group : Flavones; 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 (C) | 164.1 |
| 3 (CH) | 106.4 |
| 4 (C) | 182.9 |
| 5 (C) | 140.2 |
| 6 (C) | 139.4 |
| 7 (CH) | 115.8 |
| 8 (C) | 141.8 |
| 9 (C) | 138.4 |
| 10 (C) | 108.4 |
| 1' (C) | 121 |
| 2' (CH) | 128.3 |
| 3' (CH) | 115.8 |
| 4' (C) | 161.1 |
| 5' (CH) | 115.8 |
| 6' (CH) | 128.3 |
| 6a (CH3) | 56.8 |
| 8a (CH3) | 57.1 |
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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.