Spektraris NMR
Dehydrofurodendin
Common Name: Dehydrofurodendin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H28O3/c1-18(8-4-10-20-12-13-22(23)25-17-20)6-3-7-19(2)9-5-11-21-14-15-24-16-21/h4,6,9-10,12,14-16H,3,5,7-8,11,13,17H2,1-2H3/b10-4+,18-6+,19-9+
InChIKey: InChIKey=QJSPUICDETZEEZ-VYZVFJPZSA-N
Formula: C22H28O3
Molecular Weight: 340.456746
Exact Mass: 340.203845
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Chill, L., Rudi, A., Aknin, M., Loya, S., Hizi, A., Kashman, Y. Tetrahedron (2004) 60, 10619-26
Species:
Notes: Family : Terpenoids, Type : Sesterterpenoids, Group : Acyclics; 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) | 143 |
| 2 (CH) | 111.4 |
| 3 (C) | 125 |
| 4 (CH) | 139.3 |
| 5 (CH2) | 25.1 |
| 6 (CH2) | 28.6 |
| 7 (CH) | 124.4 |
| 8 (C) | 135 |
| 9 (CH3) | 15.2 |
| 10 (CH2) | 39.7 |
| 11 (CH2) | 26.7 |
| 12 (CH) | 125.7 |
| 13 (C) | 133 |
| 14 (CH3) | 15.2 |
| 15 (CH2) | 43.1 |
| 16 (CH) | 128.6 |
| 17 (CH) | 128.3 |
| 18 (C) | 132 |
| 19 (CH2) | 68 |
| 20 (CH) | 120.3 |
| 21 (CH2) | 30.4 |
| 22 (C) | 168 |
