Spektraris NMR
Specatolide C
Common Name: Specatolide C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O7/c1-13(20)4-3-10(18)14(2)5-9(17)11-8(6-16)12(19)21-15(11,7-13)22-14/h9,16-17,20H,3-7H2,1-2H3/t9-,13-,14-,15+/m1/s1
InChIKey: InChIKey=UTMMQAKYUSCCMW-QUAZDUCUSA-N
Formula: C15H20O7
Molecular Weight: 312.315688
Exact Mass: 312.120903
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Issa, H.H., Chang, S.M., Yang, Y.L., Chang, F.R., Wu, Y.C. Chem Pharm Bull (2006) 54, 1599-601
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Germacranes; 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) | 214.9 |
| 2 (CH2) | 40.6 |
| 3 (CH2) | 35.8 |
| 4 (C) | 71.4 |
| 5 (CH2) | 43.7 |
| 6 (C) | 106.3 |
| 7 (C) | 165 |
| 8 (CH) | 64.8 |
| 9 (CH2) | 44.2 |
| 10 (C) | 82.8 |
| 11 (C) | 126.1 |
| 12 (C) | 170.7 |
| 13 (CH2) | 54.2 |
| 14 (CH3) | 25.6 |
| 15 (CH3) | 31.8 |
