Spektraris NMR
Elisabethamine
Common Name: Elisabethamine
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H33NO2/c1-12(2)8-7-9-13(3)16-11-10-14(4)17-18(16)20(23)15(5)19(22-6)21(17)24/h8,13-14,16,22-24H,7,9-11H2,1-6H3/t13-,14-,16+/m0/s1
InChIKey: InChIKey=KZZKJBOEEWEBSF-OFQRWUPVSA-N
Formula: C21H33N1O2
Molecular Weight: 331.493052
Exact Mass: 331.251129
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ata, A., Kerr, R.G. Tetrahedron Lett (2000) 41, 5821-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Serrulatanes; 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) | 26.9 |
| 2 (CH2) | 27.7 |
| 3 (CH2) | 19.4 |
| 4 (CH) | 40.2 |
| 5 (C) | 148.9 |
| 6 (C) | 128 |
| 7 (C) | 141.6 |
| 8 (C) | 154.9 |
| 9 (C) | 132.1 |
| 10 (C) | 139.1 |
| 11 (CH) | 39.5 |
| 12 (CH2) | 36.7 |
| 13 (CH2) | 29 |
| 14 (CH) | 124 |
| 15 (C) | 133.1 |
| 16 (CH3) | 25.3 |
| 17 (CH3) | 18.9 |
| 18 (CH3) | 16.2 |
| 19 (CH3) | 20.9 |
| 20 (CH3) | 16.9 |
| 7a (CH3) | 40.6 |
