Spektraris NMR
Mansonone N
Common Name: Mansonone N
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H22O4/c1-8(2)16(19)11-6-10(4)15(20-5)14(18)13(11)9(3)7-12(16)17/h6,8-9,18-19H,7H2,1-5H3/t9-,16-/m1/s1
InChIKey: InChIKey=UVNPJKFWGLZXDE-JDNHERCYSA-N
Formula: C16H22O4
Molecular Weight: 278.344091
Exact Mass: 278.151809
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Tiew, P., Ioset, J.R., Kokpol, U., Schenk, K., Jaiboon, N., Chaichit, N., Chavasiri, W., Hostettmann, K. J Nat Prod (2002) 65, 1332-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Calamenenes; 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) | 124.6 |
| 2 (C) | 145.1 |
| 3 (C) | 144.4 |
| 4 (C) | 128.8 |
| 5 (CH) | 120.1 |
| 6 (C) | 136.5 |
| 7 (C) | 80.6 |
| 8 (C) | 212.1 |
| 9 (CH2) | 43.8 |
| 10 (CH) | 32.4 |
| 11 (CH) | 39.6 |
| 12 (CH3) | 18.2 |
| 13 (CH3) | 16.3 |
| 14 (CH3) | 16 |
| 15 (CH3) | 22 |
| 3a (CH3) | 60.6 |
