Spektraris NMR
(2E,4E,7Z)-2,6,10-Trimethyl-2,4,7,9-undecatetraenal
Common Name: (2E,4E,7Z)-2,6,10-Trimethyl-2,4,7,9-undecatetraenal
Synonyms: (2E,4E,7Z)-2,6,10-Trimethyl-2,4,7,9-undecatetraenal
CAS Registry Number:
InChI: InChI=1S/C14H20O/c1-12(2)7-5-8-13(3)9-6-10-14(4)11-15/h5-11,13H,1-4H3/b8-5-,9-6+,14-10+
InChIKey: InChIKey=QACWQRGSTMMIFT-ZLBJFZRKSA-N
Formula: C14H20O1
Molecular Weight: 204.308523
Exact Mass: 204.151415
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rueda, A., Zubia, E., Ortega, M.J., Salva, J. J Nat Prod (2001) 64, 401-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Farnesanes; 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 (CH) | 195.1 |
| 2 (C) | 136.5 |
| 3 (CH) | 149.3 |
| 4 (CH) | 123.8 |
| 5 (CH) | 148.9 |
| 6 (CH) | 35.6 |
| 7 (CH) | 130.6 |
| 8 (CH) | 124.8 |
| 9 (CH) | 119.8 |
| 10 (C) | 137.1 |
| 11 (CH3) | 18.2 |
| 12 (CH3) | 26.4 |
| 13 (CH3) | 20.5 |
| 14 (CH3) | 9.5 |
