Spektraris NMR
(5R,6E)-5-Hydroxy-1,7-diphenyl-6-hepten-3-one
Common Name: (5R,6E)-5-Hydroxy-1,7-diphenyl-6-hepten-3-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H20O2/c20-18(13-11-16-7-3-1-4-8-16)15-19(21)14-12-17-9-5-2-6-10-17/h1-11,13,18,20H,12,14-15H2/b13-11+/t18-/m0/s1
InChIKey: InChIKey=NEQGOKAKPXXESR-YLZCUGDYSA-N
Formula: C19H20O2
Molecular Weight: 280.361607
Exact Mass: 280.14633
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Brown, G.D. Phytochemistry (1998) 47, 1117-23
Species:
Notes: Family : Aromatics, Type : Phenyl-alkanoids, Group : Phenylbutanoids; 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) | 29.5 |
| 2 (CH2) | 45.2 |
| 3 (C) | 210.1 |
| 4 (CH2) | 49.3 |
| 5 (CH) | 68.6 |
| 6 (CH) | 130.1 |
| 7 (CH) | 130.5 |
| 1' (C) | 140.7 |
| 2' (CH) | 128.6 |
| 3' (CH) | 128.3 |
| 4' (CH) | 126.2 |
| 5' (CH) | 128.3 |
| 6' (CH) | 128.6 |
| 1'' (C) | 136.5 |
| 2'' (CH) | 126.5 |
| 3'' (CH) | 128.6 |
| 4'' (CH) | 127.8 |
| 5'' (CH) | 128.6 |
| 6'' (CH) | 126.5 |
