Spektraris NMR
Hydroxycolorenone
Common Name: Hydroxycolorenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-9-5-6-11(15(3,4)17)7-13-10(2)14(16)8-12(9)13/h9,11-12,17H,5-8H2,1-4H3/t9-,11?,12-/m0/s1
InChIKey: InChIKey=YXZJYDYPBCUCJX-VAGKLZBCSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Handayani, D., Edrada, R.A., Proksch, P., Wray, V., Witte, L., vanOfwegen, L., Kunzmann, A. J Nat Prod (1997) 60, 716-8
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 (CH) | 46.2 |
| 2 (CH2) | 41.8 |
| 3 (C) | 207 |
| 4 (C) | 137.8 |
| 5 (C) | 175.7 |
| 6 (CH2) | 34.3 |
| 7 (CH) | 48.9 |
| 8 (CH2) | 27.7 |
| 9 (CH2) | 37.6 |
| 10 (CH) | 36.4 |
| 11 (C) | 72.5 |
| 12 (CH3) | 26.3 |
| 13 (CH3) | 27.4 |
| 14 (CH3) | 12.4 |
| 15 (CH3) | 8 |
