Spektraris NMR
16-α-H Dihydrolinearol
Common Name: 16-α-H Dihydrolinearol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C22H36O4/c1-13-10-22-11-15(13)5-6-16(22)20(3)8-7-18(24)21(4,12-26-14(2)23)17(20)9-19(22)25/h13,15-19,24-25H,5-12H2,1-4H3/t13-,15+,16-,17-,18+,19-,20-,21+,22-/m0/s1
InChIKey: InChIKey=MBEQPJKZCPXXAK-IKPYPYLCSA-N
Formula: C22H36O4
Molecular Weight: 364.519677
Exact Mass: 364.26136
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bruno, M., Rosselli, S., Pibiri, I., Piozzi, F., Bondi, M.L., Simmonds, M.S. Phytochemistry (2001) 58, 463-74
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) | 38.4 |
| 2 (CH2) | 26.4 |
| 3 (CH) | 72.3 |
| 4 (C) | 41.8 |
| 5 (CH) | 38.2 |
| 6 (CH2) | 27.2 |
| 7 (CH) | 77.1 |
| 8 (C) | 48.5 |
| 9 (CH) | 51.4 |
| 10 (C) | 38.7 |
| 11 (CH2) | 18.3 |
| 12 (CH2) | 26.3 |
| 13 (CH) | 39.5 |
| 14 (CH2) | 39.8 |
| 15 (CH2) | 44.4 |
| 16 (CH) | 34.4 |
| 17 (CH3) | 15.6 |
| 18 (CH2) | 66.1 |
| 19 (CH3) | 11.8 |
| 20 (CH3) | 18.1 |
| 18a (C) | 171.8 |
| 18b (CH3) | 21.1 |
