Spektraris NMR
Laurefurenyne A
Common Name: Laurefurenyne A
Synonyms: Laurefurenyne A
CAS Registry Number:
InChI: InChI=1S/C15H22O4/c1-3-5-6-7-13-11(17)9-15(19-13)14-8-10(16)12(4-2)18-14/h1,5-6,10-17H,4,7-9H2,2H3/b6-5-/t10-,11-,12-,13-,14-,15-/m0/s1
InChIKey: InChIKey=SQASSOPEGUZNNA-PTSLLPCZSA-N
Formula: C15H22O4
Molecular Weight: 266.333355
Exact Mass: 266.151809
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Abdel-Mageed, W.M., Ebel, R., Valeriote, F.A., Jaspars, M. Tetrahedron (2010) 66, 2855–62
Species:
Notes: Family : Polyketides, Type : Acetogenins; 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) | 82.4 |
| 2 (C) | 80 |
| 3 (CH) | 111.3 |
| 4 (CH) | 139.9 |
| 5 (CH2) | 34.1 |
| 6 (CH) | 85.7 |
| 7 (CH) | 74.8 |
| 8 (CH2) | 37.1 |
| 9 (CH) | 79.1 |
| 10 (CH) | 78.2 |
| 11 (CH2) | 34.5 |
| 12 (CH) | 70.8 |
| 13 (CH) | 85.6 |
| 14 (CH2) | 21.8 |
| 15 (CH3) | 10.5 |
