Spektraris NMR
Cichoriolide A
Common Name: Cichoriolide A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h10-11,13,16H,1,4-7H2,2-3H3/t10-,11-,13-,15-/m0/s1
InChIKey: InChIKey=WLJQSNNKIQSGBT-UHXUCMFUSA-N
Formula: C15H20O3
Molecular Weight: 248.318068
Exact Mass: 248.141245
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Seto, M., Miyase, T., Umehara, K., Ueno, A., Hirano, Y., Otani, N. Chem Pharm Bull (1988) 36, 2423
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 (CH2) | 27 |
| 2 (CH2) | 33.2 |
| 3 (CH) | 77.6 |
| 4 (C) | 128.9 |
| 5 (C) | 126.02 |
| 6 (CH) | 83 |
| 7 (CH) | 49.6 |
| 8 (CH2) | 23 |
| 9 (CH2) | 38.3 |
| 10 (C) | 41.9 |
| 11 (C) | 139 |
| 12 (C) | 170.2 |
| 13 (CH2) | 118.3 |
| 14 (CH3) | 19.6 |
| 15 (CH3) | 18.4 |
