Spektraris NMR
Trisolidone
Common Name: Trisolidone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H14O6/c1-21-10-5-3-9(4-6-10)11-8-23-13-7-12(18)17(22-2)16(20)14(13)15(11)19/h3-8,18,20H,1-2H3
InChIKey: InChIKey=VOOFPOMXNLNEOF-UHFFFAOYSA-N
Formula: C17H14O6
Molecular Weight: 314.29011
Exact Mass: 314.079038
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Carman, R.M., Russellmaynard, J.K.L., Schumann, R.C. Aust J Chem (1985) 38, 485-96
Species:
Notes: Family : Flavonoids, Type : Isoflavonoids, Group : Isoflavones; 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 (CH) | 154.1 |
| 3 (C) | 123 |
| 4 (C) | 180.4 |
| 5 (C) | 153.3 |
| 6 (C) | 131.5 |
| 7 (C) | 157.6 |
| 8 (CH) | 93.9 |
| 9 (C) | 152.8 |
| 10 (C) | 104.9 |
| 1' (C) | 121.5 |
| 2' (CH) | 130.1 |
| 3' (CH) | 113.6 |
| 4' (C) | 159.2 |
| 5' (CH) | 113.6 |
| 6' (CH) | 130.1 |
| 6a (CH3) | 55.1 |
| 4'a (CH3) | 59.6 |
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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.