Spektraris NMR
Tilifolidione
Common Name: Tilifolidione
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H22O4/c1-11(2)16-17(22)15-10-13-12(7-6-8-21(3,4)20(13)24)9-14(15)18(23)19(16)25-5/h6-7,9-11H,8H2,1-5H3
InChIKey: InChIKey=ONABFGHPQWMPCU-UHFFFAOYSA-N
Formula: C21H22O4
Molecular Weight: 338.39777
Exact Mass: 338.151809
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Luis, J.G., Quinones, W., Echeverri, F. Phytochemistry (1994) 36, 115-7
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abeo-Abietanes; 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) | 129.9 |
| 2 (CH) | 135.4 |
| 3 (CH2) | 29.3 |
| 4 (C) | 55.1 |
| 5 (C) | 206.1 |
| 6 (C) | 134.4 |
| 7 (CH) | 158.7 |
| 8 (C) | 113.4 |
| 9 (C) | 131.6 |
| 10 (C) | 141.1 |
| 11 (C) | 180.8 |
| 12 (C) | 158.6 |
| 13 (C) | 140.4 |
| 14 (C) | 190.4 |
| 15 (CH) | 29.7 |
| 16 (CH3) | 20.4 |
| 17 (CH3) | 20.4 |
| 18 (CH3) | 23.7 |
| 19 (CH3) | 23.7 |
| 20 (CH) | 118.5 |
| 12a (CH3) | 61.2 |
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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.