Spektraris NMR
Myrrhanolide B
Common Name: Myrrhanolide B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O4/c1-7-4-10-12(11(16)5-7)8(2)6-15(18)13(10)9(3)14(17)19-15/h7-8,18H,4-6H2,1-3H3/t7-,8-,15+/m0/s1
InChIKey: InChIKey=GOVDXHQBFLNYLG-VJGMYXETSA-N
Formula: C15H18O4
Molecular Weight: 262.301592
Exact Mass: 262.120509
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Shen, T., Wan, W.Z., Wang, X.N., Yuan, H.Q., Ji, M., Lou, H.X. Helv Chim Acta (2009) 92, 645-52
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Cadinanes; 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) | 142.2 |
| 2 (C) | 199.5 |
| 3 (CH2) | 47.7 |
| 4 (CH) | 31.5 |
| 5 (CH2) | 36.5 |
| 6 (C) | 140.9 |
| 7 (C) | 153.7 |
| 8 (C) | 101.7 |
| 9 (CH2) | 39.9 |
| 10 (CH) | 28.7 |
| 11 (C) | 124.7 |
| 12 (C) | 171.8 |
| 13 (CH3) | 10.4 |
| 14 (CH3) | 20.8 |
| 15 (CH3) | 21.7 |
