Spektraris NMR
11,13-Dehydrodesacetylmatricarin
Common Name: 11,13-Dehydrodesacetylmatricarin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H16O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,10,12-14,17H,3-4H2,1-2H3/t10-,12-,13+,14+/m0/s1
InChIKey: InChIKey=LLUKLZVIROBDGI-SCUASFONSA-N
Formula: C15H16O4
Molecular Weight: 260.28571
Exact Mass: 260.104859
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Ohno, N., Gershenzon, J., Roane, C., Mabry, T.J. Phytochemistry (1980) 19, 103
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 134.2 |
| 2 (C) | 195.5 |
| 3 (CH) | 136 |
| 4 (C) | 170.7 |
| 5 (CH) | 52 |
| 6 (CH) | 82.5 |
| 7 (CH) | 58.3 |
| 8 (CH) | 68.2 |
| 9 (CH2) | 49.4 |
| 10 (C) | 146.2 |
| 11 (C) | 139.2 |
| 12 (C) | 169.5 |
| 13 (CH2) | 121.8 |
| 14 (CH3) | 21.3 |
| 15 (CH3) | 19.8 |
