Spektraris NMR
3β-[(2-methylacryloyl)oxy]-8-oxo-12-noreremophil-6-en-11-one
![3β-[(2-methylacryloyl)oxy]-8-oxo-12-noreremophil-6-en-11-one](/nmr/static/nmr/svg/18612.svg)
Common Name: 3β-[(2-methylacryloyl)oxy]-8-oxo-12-noreremophil-6-en-11-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C18H24O4/c1-10(2)17(21)22-16-7-6-13-8-15(20)14(12(4)19)9-18(13,5)11(16)3/h9,11,13,16H,1,6-8H2,2-5H3/t11-,13+,16-,18+/m0/s1
InChIKey: InChIKey=LLFNQWDJWWUKMU-QRKZQPCCSA-N
Formula: C18H24O4
Molecular Weight: 304.381444
Exact Mass: 304.167459
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhang, Z.X., Fei, D.Q., Jia, Z.J. Helv Chim Acta (2008) 91, 1045-52
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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 (CH2) | 24.4 |
| 2 (CH2) | 24.4 |
| 3 (CH) | 73.5 |
| 4 (CH) | 36.7 |
| 5 (C) | 40.3 |
| 6 (CH) | 163.7 |
| 7 (C) | 137.3 |
| 8 (C) | 196.5 |
| 9 (CH2) | 40.7 |
| 10 (CH) | 40.3 |
| 11 (C) | 197.9 |
| 13 (CH3) | 30.7 |
| 14 (CH3) | 23.8 |
| 15 (CH3) | 9.5 |
| 3a (C) | 166.7 |
| 3b (C) | 136.5 |
| 3c (CH2) | 125.4 |
| 3ba (CH3) | 18.3 |
