Spektraris NMR
9α,10β-Dihydroxy-2β,4β-peroxy-1r,5β,7rH-guaiane
Common Name: 9α,10β-Dihydroxy-2β,4β-peroxy-1r,5β,7rH-guaiane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O4/c1-8(2)9-5-10-13(15(4,17)12(16)6-9)11-7-14(10,3)19-18-11/h8-13,16-17H,5-7H2,1-4H3/t9-,10-,11+,12+,13-,14-,15-/m0/s1
InChIKey: InChIKey=USEWIKYKYDMBSN-XTELSCJUSA-N
Formula: C15H26O4
Molecular Weight: 270.365118
Exact Mass: 270.183109
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Aguilar-Guadarrama, A.B., Rios, M.Y. J Nat Prod (2004) 67, 914-7
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 41.6 |
| 2 (CH) | 68.7 |
| 3 (CH2) | 30.2 |
| 4 (C) | 87.4 |
| 5 (CH) | 61.8 |
| 6 (CH2) | 31.5 |
| 7 (CH) | 47.5 |
| 8 (CH2) | 26.6 |
| 9 (CH) | 86.8 |
| 10 (C) | 77.4 |
| 11 (CH) | 28.5 |
| 12 (CH3) | 21.4 |
| 13 (CH3) | 21.3 |
| 14 (CH3) | 21.5 |
| 15 (CH3) | 32.1 |
