Spektraris NMR
Peroxygibberol
Common Name: Peroxygibberol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O3/c1-10(2)14-6-5-11(3)15(18-17-14)8-7-13(4,16)12(15)9-14/h9-11,16H,5-8H2,1-4H3/t11-,13+,14-,15-/m0/s1
InChIKey: InChIKey=SKFOIZZOJVDBEP-ATGSNQNLSA-N
Formula: C15H24O3
Molecular Weight: 252.349831
Exact Mass: 252.172545
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ahmed, A.F., Kuo, Y.H., Dai, C.F., Sheu, J.H. J Nat Prod (2005) 68, 1208-12
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 (C) | 89.3 |
| 2 (CH2) | 34.9 |
| 3 (CH2) | 39 |
| 4 (C) | 78.5 |
| 5 (C) | 152.4 |
| 6 (CH) | 120 |
| 7 (C) | 83.2 |
| 8 (CH2) | 30.9 |
| 9 (CH2) | 28.2 |
| 10 (CH) | 39.1 |
| 11 (CH) | 35.6 |
| 12 (CH3) | 17 |
| 13 (CH3) | 17.1 |
| 14 (CH3) | 13.7 |
| 15 (CH3) | 25.2 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.