Spektraris NMR
1-(7-hydroxy-2,6-dimethyl-1-naphthyl)-4-methyl-3-pentanone
Common Name: 1-(7-hydroxy-2,6-dimethyl-1-naphthyl)-4-methyl-3-pentanone
Synonyms: 1-(7-hydroxy-2,6-dimethyl-1-naphthyl)-4-methyl-3-pentanone
CAS Registry Number:
InChI: InChI=1S/C18H22O2/c1-11(2)17(19)8-7-15-12(3)5-6-14-9-13(4)18(20)10-16(14)15/h5-6,9-11,20H,7-8H2,1-4H3
InChIKey: InChIKey=GWIKNMRFHCFVPY-UHFFFAOYSA-N
Formula: C18H22O2
Molecular Weight: 270.366753
Exact Mass: 270.16198
NMR Solvent: CD3COCD3
MHz:
Calibration:
NMR references: 13C - Yuan, W., Lu, Z., Liu, Y., Meng, C., Cheng, K.D., Zhu, P. Chem Pharm Bull (2005) 53, 1610-2
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Podocarpanes; 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) | 40.28 |
| 2 (CH2) | 23.56 |
| 3 (C) | 213.58 |
| 4 (CH) | 41.27 |
| 5 (C) | 133.05 |
| 6 (CH) | 126.94 |
| 7 (CH) | 126.2 |
| 8 (C) | 128.79 |
| 9 (C) | 133.05 |
| 10 (C) | 132.83 |
| 11 (CH) | 105.26 |
| 12 (C) | 155.62 |
| 13 (C) | 126.52 |
| 14 (CH) | 130.54 |
| 15 (CH3) | 16.53 |
| 18 (CH3) | 18.48 |
| 19 (CH3) | 18.48 |
| 20 (CH3) | 20.02 |
