Spektraris NMR
Securixanthone B
Common Name: Securixanthone B
Synonyms: Securixanthone B
CAS Registry Number:
InChI: InChI=1S/C15H12O5/c1-18-8-3-5-11-10(7-8)13(16)9-4-6-12(19-2)14(17)15(9)20-11/h3-7,17H,1-2H3
InChIKey: InChIKey=MFXGHYSTFDEGTO-UHFFFAOYSA-N
Formula: C15H12O5
Molecular Weight: 272.253352
Exact Mass: 272.068473
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Yang, X.D., Xu, L.Z., Yang, S.L. Phytochemistry (2001) 58, 1245-9
Species:
Notes: Family : Aromatics, Type : Xanthones; 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) | 124 |
| 2 (CH) | 113.5 |
| 3 (C) | 149.8 |
| 4 (C) | 145.2 |
| 4a (C) | 146.6 |
| 5 (CH) | 119.2 |
| 6 (CH) | 124.1 |
| 7 (C) | 155.5 |
| 8 (CH) | 106 |
| 8a (C) | 121.9 |
| 9 (C) | 175 |
| 9a (C) | 115.8 |
| 10a (C) | 149.5 |
| 1' (CH3) | 61 |
| 1'' (CH3) | 55.7 |
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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.