Spektraris NMR
MEGxp0_001143
Common Name: MEGxp0_001143
Synonyms: MEGxp0_001143
CAS Registry Number:
InChI: InChI=1S/C19H28O6/c1-6-14(5)18(22)25-11-19(23,10-24-17(21)12(2)3)15-8-7-13(4)9-16(15)20/h7-9,12,14,20,23H,6,10-11H2,1-5H3
InChIKey: InChIKey=IHCGYZLHGZMPTF-UHFFFAOYSA-N
Formula: C19H28O6
Molecular Weight: 352.422753
Exact Mass: 352.188589
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Su, B.N., Takaishi, Y., Yabuuchi, T., Kusumi, T., Tori, M., Takaoka, S., Honda, G., Ito, M., Takeda, Y., Kodzhimatov, O.K., Ashurmetov, O. J Nat Prod (2001) 64, 466-71
Species:
Notes: Family : Terpenoids, Type : Monoterpenoids, Group : p-Menthanes; 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) | 140.1 |
| 2 (CH) | 118.5 |
| 3 (C) | 156.5 |
| 4 (C) | 119.2 |
| 5 (CH) | 126.6 |
| 6 (CH) | 120.5 |
| 7 (CH3) | 21 |
| 8 (C) | 78.5 |
| 9 (CH2) | 67.31 |
| 10 (CH2) | 67.25 |
| 9a (C) | 177.5 |
| 9b (CH) | 34 |
| 9c (CH3) | 18.9 |
| 9ba (CH3) | 18.9 |
| 10a (C) | 177.2 |
| 10b (CH) | 41 |
| 10c (CH2) | 26.6 |
| 10d (CH3) | 11.5 |
| 10ba (CH3) | 16.5 |
