Spektraris NMR
Cinnamadin
Common Name: Cinnamadin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H24O5/c1-9(18)22-13-12(19)11-10(8-21-15(11)20)17(4)7-5-6-16(2,3)14(13)17/h12-14,19H,5-8H2,1-4H3/t12-,13+,14-,17+/m0/s1
InChIKey: InChIKey=IXRCUCMDEOVZLM-QDEZUTFSSA-N
Formula: C17H24O5
Molecular Weight: 308.370113
Exact Mass: 308.162374
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Harinantenaina, L., Matsunami, K., Otsuka, H., Kawahata, M., Yamaguchi, K., Asakawa, Y. J Nat Prod (2008) 71, 123-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Drimanes; 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) | 38.4 |
| 2 (CH2) | 18.5 |
| 3 (CH2) | 42.8 |
| 4 (C) | 33.5 |
| 5 (CH) | 48.5 |
| 6 (CH) | 72.3 |
| 7 (CH) | 63.6 |
| 8 (C) | 122.7 |
| 9 (C) | 173.6 |
| 10 (C) | 37.2 |
| 11 (CH2) | 68.5 |
| 12 (C) | 169.9 |
| 13 (CH3) | 33 |
| 14 (CH3) | 23.1 |
| 15 (CH3) | 22.5 |
| 6a (C) | 170 |
| 6b (CH3) | 21.3 |
