Spektraris NMR
Oxyphyllone D
Common Name: Oxyphyllone D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H18O2/c1-9(2)14(16)7-6-13(15)11-5-4-10(3)8-12(11)14/h4-5,8-9,16H,6-7H2,1-3H3/t14-/m1/s1
InChIKey: InChIKey=MTSNNQKEEOCXOZ-CQSZACIVSA-N
Formula: C14H18O2
Molecular Weight: 218.292046
Exact Mass: 218.13068
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Xu, J.J., Tan, N.H., Chen, Y.S., Pan, X.L., Zeng, G.Z., Han, H.J., Ji, C.J., Zhu, M.J. Helv Chim Acta (2009) 92, 1621-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Calamenenes; 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) | 128.8 |
| 2 (CH) | 127.4 |
| 3 (CH) | 128.8 |
| 4 (C) | 144.1 |
| 5 (CH) | 126.2 |
| 6 (C) | 148.7 |
| 7 (C) | 73.7 |
| 8 (CH2) | 33 |
| 9 (CH2) | 34.6 |
| 10 (C) | 197.4 |
| 11 (CH) | 34.9 |
| 12 (CH3) | 17.5 |
| 13 (CH3) | 16.3 |
| 14 (CH3) | 44 |
