Spektraris NMR
Isomicrocionin-1
Common Name: Isomicrocionin-1
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O/c1-11-5-4-8-15(3)13-12(7-10-16-13)6-9-14(11,15)2/h7,10-11H,4-6,8-9H2,1-3H3/t11-,14-,15-/m0/s1
InChIKey: InChIKey=RZAVBLXEFARMMG-CQDKDKBSSA-N
Formula: C15H22O1
Molecular Weight: 218.33514
Exact Mass: 218.167065
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Gaspar, H., Santos, S., Carbone, M., Rodrigues, A.S., Rodrigues, A.I., Uriz, M.J., Feio, S.M.S., Melck, D., Humanes, M., Gavagnin, M. J Nat Prod (2008) 71, 2049-52
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : 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 (CH2) | 37.7 |
| 2 (CH2) | 22.1 |
| 3 (CH2) | 30.6 |
| 4 (CH) | 37 |
| 5 (C) | 38.5 |
| 6 (CH2) | 23.8 |
| 7 (CH2) | 18.7 |
| 8 (C) | 112.6 |
| 9 (C) | 159.1 |
| 10 (C) | 38.1 |
| 11 (CH) | 109.9 |
| 12 (CH) | 140.1 |
| 13 (CH3) | 16.6 |
| 14 (CH3) | 16.6 |
| 15 (CH3) | 21.1 |
