Spektraris NMR
Plagiochiline X
Common Name: Plagiochiline X
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O/c1-9-5-6-12-14(15(12,3)4)13-10(2)7-16-8-11(9)13/h5,8,12-14H,2,6-7H2,1,3-4H3/t12-,13-,14-/m0/s1
InChIKey: InChIKey=MPCQKDYYHFZZAW-IHRRRGAJSA-N
Formula: C15H20O1
Molecular Weight: 216.319258
Exact Mass: 216.151415
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Adio, A.M., Konig, W.A. Phytochemistry (2005) 66, 599-609
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Aromadendranes; 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 (C) | 119.6 |
| 2 (CH) | 143.2 |
| 3 (CH2) | 68.8 |
| 4 (C) | 144.6 |
| 5 (CH) | 36 |
| 6 (CH) | 33.5 |
| 7 (CH) | 29.1 |
| 8 (CH2) | 24.7 |
| 9 (CH) | 125.4 |
| 10 (C) | 132.6 |
| 11 (C) | 19.4 |
| 12 (CH3) | 15.6 |
| 13 (CH3) | 28.9 |
| 14 (CH3) | 23.1 |
| 15 (CH2) | 111.6 |
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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.