Spektraris NMR
Peruvianoxide
Common Name: Peruvianoxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C11H16O3/c1-10(2)5-7(12)6-11(3)8(10)4-9(13)14-11/h4,7,12H,5-6H2,1-3H3/t7-,11+/m0/s1
InChIKey: InChIKey=XEVQXKKKAVVSMW-WRWORJQWSA-N
Formula: C11H16O3
Molecular Weight: 196.243362
Exact Mass: 196.109944
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Lan, Y.H., Chang, F.R., Pan, M.J., Wu, C.C., Wu, S.J., Chen, S.L., Wang, S.S., Wu, M.J., Wu, Y.C. Food Chem (2009) 116, 462-9
Species:
Notes: Family : Miscellanea; 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) | 36.2 |
| 2 (CH2) | 47.6 |
| 3 (CH) | 65.9 |
| 4 (CH2) | 46.4 |
| 5 (C) | 87 |
| 6 (C) | 182.9 |
| 7 (CH) | 113.1 |
| 8 (C) | 171.8 |
| 9 (CH3) | 30.6 |
| 10 (CH3) | 26.5 |
| 11 (CH3) | 27.3 |
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