Spektraris NMR
Grandilobalide C
Common Name: Grandilobalide C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O5/c1-7-3-4-13(2)8-10(16)18-6-14(7,13)5-15(8)9-11(19-9)20-12(15)17/h7-9,11H,3-6H2,1-2H3/t7-,8+,9-,11-,13+,14-,15-/m1/s1
InChIKey: InChIKey=FQVVCFPBZGQJRN-IVILPNOJSA-N
Formula: C15H18O5
Molecular Weight: 278.300997
Exact Mass: 278.115424
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Tazaki, H., Ishikawa, F., Soutome, H., Nabeta, K. Phytochemistry (1998) 48, 851-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Pinguisanes; 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) | 38.2 |
| 2 (CH2) | 33.5 |
| 3 (CH2) | 34.6 |
| 4 (CH) | 62.3 |
| 5 (C) | 53.3 |
| 6 (C) | 178.5 |
| 7 (CH2) | 47.3 |
| 8 (C) | 53 |
| 9 (C) | 54 |
| 10 (CH) | 59.1 |
| 11 (CH) | 77.7 |
| 12 (CH2) | 75.3 |
| 13 (CH3) | 19.3 |
| 14 (CH3) | 19.8 |
| 15 (C) | 169.2 |
