Spektraris NMR
Acetyllimbinol
Common Name: Acetyllimbinol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H26O4/c1-12(2)9-20(26-15(6)23)22(25)21-14(5)7-8-16-10-17(13(3)4)19(24)11-18(16)21/h7-11,13,20,24H,1-6H3
InChIKey: InChIKey=VBKPPWYSAHAAGV-UHFFFAOYSA-N
Formula: C22H26O4
Molecular Weight: 354.440269
Exact Mass: 354.183109
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ulubelen, A., Topcu, G., Sonmez, U., Eris, C., Ozgen, U. Phytochemistry (1996) 43, 431-4
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) | 196 |
| 2 (CH) | 65.3 |
| 3 (CH) | 125.2 |
| 4 (C) | 126.3 |
| 5 (C) | 144.6 |
| 6 (CH) | 135.6 |
| 7 (CH) | 130.4 |
| 8 (C) | 135.6 |
| 9 (C) | 130.8 |
| 10 (C) | 125.2 |
| 11 (CH) | 127.1 |
| 12 (C) | 136.3 |
| 13 (C) | 125.2 |
| 14 (CH) | 126.3 |
| 15 (CH) | 27.1 |
| 16 (CH3) | 19.8 |
| 17 (CH3) | 20.1 |
| 18 (CH3) | 17.6 |
| 19 (CH3) | 26.8 |
| 20 (CH3) | 20.3 |
| 2a (C) | 170.1 |
| 2b (CH3) | 23.1 |
