Spektraris NMR
De-O-ethylsalvonitin
Common Name: De-O-ethylsalvonitin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H24O3/c1-10(2)8-15-19(22)16-12(5)6-7-13-9-14(11(3)4)18(21)20(23-15)17(13)16/h6-9,11,15,19,21-22H,1-5H3/t15-,19+/m0/s1
InChIKey: InChIKey=ACUFRNMZLVESRV-HNAYVOBHSA-N
Formula: C20H24O3
Molecular Weight: 312.403511
Exact Mass: 312.172545
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Lin, L.Z., Cordell, G.A., Lin, P. Phytochemistry (1995) 40, 1469-71
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 (CH) | 67.3 |
| 2 (CH) | 77.6 |
| 3 (CH) | 120 |
| 4 (C) | 132.7 |
| 5 (C) | 132.7 |
| 6 (CH) | 126.9 |
| 7 (CH) | 127.6 |
| 8 (C) | 126.3 |
| 9 (C) | 119.1 |
| 10 (C) | 124.3 |
| 11 (C) | 139.4 |
| 12 (C) | 140 |
| 13 (C) | 136.7 |
| 14 (CH) | 116.2 |
| 15 (CH) | 27.7 |
| 16 (CH3) | 22.9 |
| 17 (CH3) | 22.3 |
| 18 (CH3) | 25.1 |
| 19 (CH3) | 18.7 |
| 20 (CH3) | 17.1 |
