Spektraris NMR
Ptrodontriol A
Common Name: Ptrodontriol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H28O3/c1-13(2,17)10-5-6-14(3)8-11(16)9-15(4,18)12(14)7-10/h10-12,16-18H,5-9H2,1-4H3/t10-,11+,12+,14+,15-/m0/s1
InChIKey: InChIKey=QRVJFHKYVKNIIK-PRSHDEELSA-N
Formula: C15H28O3
Molecular Weight: 256.381594
Exact Mass: 256.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Li, S.L., Ding, J.K., Jiang, B., Na, B.B. Phytochemistry (1998) 49, 2035-6
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 52.7 |
| 2 (CH) | 65.7 |
| 3 (CH2) | 54.4 |
| 4 (C) | 72.4 |
| 5 (CH) | 49.4 |
| 6 (CH2) | 21.7 |
| 7 (CH) | 43.1 |
| 8 (CH2) | 21.8 |
| 9 (CH2) | 42.8 |
| 10 (C) | 34.4 |
| 11 (C) | 73.8 |
| 12 (CH3) | 29.7 |
| 13 (CH3) | 30.6 |
| 14 (CH3) | 20.5 |
| 15 (CH3) | 24 |
