Spektraris NMR
Indicumolide B
Common Name: Indicumolide B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H24O6/c1-7-5-11(22-9(3)18)13-8(2)16(20)23-15(13)14-10(7)6-12(19)17(14,4)21/h8,11-15,19,21H,5-6H2,1-4H3/t8-,11+,12+,13-,14+,15+,17+/m1/s1
InChIKey: InChIKey=TXHCRRBMSROPJF-WWKHQLGGSA-N
Formula: C17H24O6
Molecular Weight: 324.369518
Exact Mass: 324.157289
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Feng, Z.M., Song, S., Xia, P.F., Jiang, J.S., Zhang, P.C. Helv Chim Acta (2009) 92, 1823-8
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) | 137.1 |
| 2 (CH2) | 39 |
| 3 (CH) | 78.8 |
| 4 (C) | 83.2 |
| 5 (CH) | 52.8 |
| 6 (CH) | 79 |
| 7 (CH) | 58.1 |
| 8 (CH) | 71.6 |
| 9 (CH2) | 41.8 |
| 10 (C) | 126.4 |
| 11 (CH) | 40.7 |
| 12 (C) | 177.5 |
| 13 (CH3) | 15.1 |
| 14 (CH3) | 23.5 |
| 15 (CH3) | 24 |
| 8a (C) | 169.9 |
| 8b (CH3) | 21.2 |
