Spektraris NMR
allo-Cedrol
Common Name: allo-Cedrol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O/c1-10-5-6-11-13(2,3)14(4)7-8-15(10,11)9-12(14)16/h10-12,16H,5-9H2,1-4H3/t10-,11+,12?,14-,15-/m0/s1
InChIKey: InChIKey=CSTOJISGDOIIDQ-ZONIWEOESA-N
Formula: C15H26O1
Molecular Weight: 222.366903
Exact Mass: 222.198365
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bungert, M., Gabler, J., Adam, K.P., Zapp, J., Becker, H. Phytochemistry (1998) 49, 1079-83
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : allo-Cedranes; 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) | 41.35 |
| 2 (CH) | 40.02 |
| 3 (CH2) | 35 |
| 4 (CH2) | 24.24 |
| 5 (CH) | 53.12 |
| 6 (C) | 34.47 |
| 7 (C) | 39.77 |
| 8 (CH2) | 24.23 |
| 9 (CH2) | 30.98 |
| 10 (CH) | 71 |
| 11 (CH2) | 40.74 |
| 12 (CH3) | 17.64 |
| 13 (CH3) | 26.27 |
| 14 (CH3) | 21 |
| 15 (CH3) | 16.14 |
