Spektraris NMR
16-Hydroxymanoyloxide
Common Name: 16-Hydroxymanoyloxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O2/c1-6-20(14-21)13-9-16-18(4)11-7-10-17(2,3)15(18)8-12-19(16,5)22-20/h6,15-16,21H,1,7-14H2,2-5H3/t15-,16+,18-,19+,20-/m0/s1
InChIKey: InChIKey=CMXOSVFYCJCFHE-ZRSLWSEBSA-N
Formula: C20H34O2
Molecular Weight: 306.483513
Exact Mass: 306.25588
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Dolmazon, R., Albrand, M., Bessiere, J.M., Mahmout, Y., Wernerowska, D., Kolodziejczyk, K. Phytochemistry (1995) 38, 917-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 38.9 |
| 2 (CH2) | 18.5 |
| 3 (CH2) | 42 |
| 4 (C) | 33.2 |
| 5 (CH) | 56.4 |
| 6 (CH2) | 20.2 |
| 7 (CH2) | 43.6 |
| 8 (C) | 76.3 |
| 9 (CH) | 52.8 |
| 10 (C) | 37.2 |
| 11 (CH2) | 14.5 |
| 12 (CH2) | 27.2 |
| 13 (C) | 75.6 |
| 14 (CH) | 144 |
| 15 (CH2) | 114 |
| 16 (CH2) | 68.5 |
| 17 (CH3) | 25.8 |
| 18 (CH3) | 33.4 |
| 19 (CH3) | 21.5 |
| 20 (CH3) | 15.1 |
