Spektraris NMR
1-Oxomiltirone
Common Name: 1-Oxomiltirone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H20O3/c1-10(2)12-9-11-5-6-13-16(15(11)18(22)17(12)21)14(20)7-8-19(13,3)4/h5-6,9-10H,7-8H2,1-4H3
InChIKey: InChIKey=VPIMKJVQYOXHSS-UHFFFAOYSA-N
Formula: C19H20O3
Molecular Weight: 296.361012
Exact Mass: 296.141245
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Sairafianpour, M., Christensen, J., Staerk, D., Budnik, B.A., Kharazmi, A., Bagherzadeh, K., Jaroszewski, J.W. J Nat Prod (2001) 64, 1398-403
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) | 198.84 |
| 2 (CH2) | 36.15 |
| 3 (CH2) | 36.58 |
| 4 (C) | 34.93 |
| 5 (C) | 153.78 |
| 6 (CH) | 130.94 |
| 7 (CH) | 131.87 |
| 8 (C) | 132.82 |
| 9 (C) | 135.51 |
| 10 (C) | 138.03 |
| 11 (C) | 183.14 |
| 12 (C) | 183.76 |
| 13 (C) | 146.47 |
| 14 (CH) | 137.85 |
| 15 (CH) | 27 |
| 16 (CH3) | 21.56 |
| 17 (CH3) | 21.56 |
| 18 (CH3) | 28.83 |
| 19 (CH3) | 28.83 |
