Spektraris NMR
Dictamnol
Common Name: Dictamnol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C12H18O/c1-9-5-3-4-6-11-10(9)7-8-12(11,2)13/h4,6,10-11,13H,1,3,5,7-8H2,2H3/t10-,11+,12-/m0/s1
InChIKey: InChIKey=FIZZAWTVIDYQPI-TUAOUCFPSA-N
Formula: C12H18O1
Molecular Weight: 178.271169
Exact Mass: 178.135765
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhao, P.H., Yang, X.P., Yuan, C.S. Nat Prod Res (2008) 22, 208-11
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) | 47.1 |
| 2 (CH2) | 25.3 |
| 3 (CH2) | 40.1 |
| 4 (C) | 80.4 |
| 5 (CH) | 55.5 |
| 6 (CH) | 129.7 |
| 7 (CH) | 131.8 |
| 8 (CH2) | 28.7 |
| 9 (CH2) | 36.7 |
| 10 (C) | 153.4 |
| 14 (CH2) | 107.1 |
| 15 (CH3) | 24.1 |
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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.