Spektraris NMR
Gorgonolide
Common Name: Gorgonolide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O4/c1-7-9-4-5-14(3)15(19-14)6-10(16)8(2)11(15)12(9)18-13(7)17/h7,9,12H,4-6H2,1-3H3/t7-,9-,12-,14+,15-/m0/s1
InChIKey: InChIKey=RUBXBCDKYAQXTM-IAJDZVHGSA-N
Formula: C15H18O4
Molecular Weight: 262.301592
Exact Mass: 262.120509
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ortet, R., Prado, S., Mouray, E., Thomas, O.P. Phytochemistry (2008) 69, 2961-5
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) | 68.2 |
| 2 (CH2) | 40.8 |
| 3 (C) | 203 |
| 4 (C) | 141.4 |
| 5 (C) | 158.9 |
| 6 (CH) | 82.2 |
| 7 (CH) | 50.2 |
| 8 (CH2) | 24.5 |
| 9 (CH2) | 33.6 |
| 10 (C) | 65.9 |
| 11 (CH) | 41.4 |
| 12 (C) | 177.3 |
| 13 (CH3) | 12.9 |
| 14 (CH3) | 25.7 |
| 15 (CH3) | 9.3 |
