Spektraris NMR
Polyalcohol A
Common Name: Polyalcohol A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O6/c1-7-4-5-8(17)14(6-16)12(20)10(18)9-11(19)15(7,14)21-13(9,2)3/h7-12,16-20H,4-6H2,1-3H3/t7-,8+,9-,10-,11-,12+,14+,15-/m0/s1
InChIKey: InChIKey=CWVDPLZZDOZUHC-DXVBYQQXSA-N
Formula: C15H26O6
Molecular Weight: 302.363928
Exact Mass: 302.172939
NMR Solvent: DMSO-d6
MHz:
Calibration:
NMR references: 13C - den Hertog, H.J., Kruk, C., Nanavati, D.D., Dev, S. Tetrahedron Lett (1974) 15, 2219
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Agarofurans; 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 (CH) | 71 |
| 2 (CH2) | 26 |
| 3 (CH2) | 27.6 |
| 4 (CH) | 33.5 |
| 5 (C) | 91.3 |
| 6 (CH) | 74.8 |
| 7 (CH) | 58.1 |
| 8 (CH) | 74.8 |
| 9 (CH) | 71.4 |
| 10 (C) | 53.1 |
| 11 (C) | 80.2 |
| 12 (CH3) | 26.4 |
| 13 (CH3) | 31.5 |
| 14 (CH2) | 62.9 |
| 15 (CH3) | 17.6 |
