Spektraris NMR
Sesquiterpene FF-1
Common Name: Sesquiterpene FF-1
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O3/c1-8-10-6-11-9(2)12(16)4-5-15(11,3)7-13(10)18-14(8)17/h4-5,10-13,16H,1-2,6-7H2,3H3/t10-,11+,12-,13-,15-/m1/s1
InChIKey: InChIKey=IAQSDVSTWFUONY-WPLOAARJSA-N
Formula: C15H18O3
Molecular Weight: 246.302187
Exact Mass: 246.125594
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Jakupovic, J., Schuster, A., Bohlmann, F., Dillon, M.O. Phytochemistry (1988) 27, 1113-20
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 124.5 |
| 2 (CH) | 142.4 |
| 3 (CH) | 69.6 |
| 4 (C) | 148.7 |
| 5 (CH) | 40.4 |
| 6 (CH2) | 26.8 |
| 7 (CH) | 40.6 |
| 8 (CH) | 76.6 |
| 9 (CH2) | 38.4 |
| 10 (C) | 36.5 |
| 11 (C) | 14.6 |
| 12 (C) | 170.3 |
| 13 (CH2) | 120.7 |
| 14 (CH3) | 19.2 |
| 15 (CH2) | 111.7 |
