Spektraris NMR
RWYDVRJTCLGVMS-ZHCMNPPYSA-
Common Name: RWYDVRJTCLGVMS-ZHCMNPPYSA-
Synonyms: RWYDVRJTCLGVMS-ZHCMNPPYSA-
CAS Registry Number:
InChI: InChI=1S/C20H32O3/c1-7-18(4)10-8-14-19(5)11-9-15(22)17(2,3)16(19)13(21)12-20(14,6)23-18/h7,13-14,16,21H,1,8-12H2,2-6H3/t13-,14-,16+,18-,19-,20-/m0/s1
InChIKey: InChIKey=RWYDVRJTCLGVMS-ZHCMNPPYSA-N
Formula: C20H32O3
Molecular Weight: 320.467037
Exact Mass: 320.235145
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Garcia-Granados, A., Jimenez, M.B., Martinez, A., Parra, A., Rivas, F., Arias, J.M. Phytochemistry (1994) 37, 741-7
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) | 41 |
| 2 (CH2) | 34.3 |
| 3 (C) | 216.1 |
| 4 (C) | 49.1 |
| 5 (CH) | 58.7 |
| 6 (CH) | 69.6 |
| 7 (CH2) | 50.8 |
| 8 (C) | 75 |
| 9 (CH) | 56.9 |
| 10 (C) | 36.8 |
| 11 (CH2) | 16.3 |
| 12 (CH2) | 34.9 |
| 13 (C) | 73.5 |
| 14 (CH) | 147.6 |
| 15 (CH2) | 109.6 |
| 16 (CH3) | 32.9 |
| 17 (CH3) | 24.6 |
| 18 (CH3) | 25.1 |
| 19 (CH3) | 23.6 |
| 20 (CH3) | 16.6 |
