Spektraris NMR
foliol acetonide
Common Name: foliol acetonide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C23H36O3/c1-14-11-23-12-15(14)6-7-16(23)21(4)9-8-19-22(5,17(21)10-18(23)24)13-25-20(2,3)26-19/h15-19,24H,1,6-13H2,2-5H3/t15-,16+,17+,18+,19-,21+,22-,23+/m1/s1
InChIKey: InChIKey=HDJUHCGQVBSWNI-BGTVMMHMSA-N
Formula: C23H36O3
Molecular Weight: 360.531008
Exact Mass: 360.266445
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Baser, K.H.C., Bondi, M.L., Bruno, M., Kirimer, N., Piozzi, F., Tumen, G., Vassallo, N. Phytochemistry (1996) 43, 1293-5
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 39.7 |
| 2 (CH2) | 24.4 |
| 3 (CH) | 78.3 |
| 4 (C) | 42.9 |
| 5 (CH) | 42.1 |
| 6 (CH2) | 27.4 |
| 7 (CH) | 77.5 |
| 8 (C) | 49 |
| 9 (CH) | 51 |
| 10 (C) | 36.9 |
| 11 (CH2) | 18.3 |
| 12 (CH2) | 34.2 |
| 13 (CH) | 44.4 |
| 14 (CH2) | 38.9 |
| 15 (CH2) | 45.8 |
| 16 (C) | 155.2 |
| 17 (CH2) | 104.5 |
| 18 (CH2) | 73.3 |
| 19 (CH3) | 13 |
| 20 (CH3) | 19.4 |
| 3a (C) | 99.66 |
| 3aa (CH3) | 30.53 |
| 3ab (CH3) | 20.04 |
