Spektraris NMR
Cyperotundone
Common Name: Cyperotundone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O/c1-9-5-6-11-7-12-10(2)13(16)8-15(9,12)14(11,3)4/h9,11H,5-8H2,1-4H3/t9-,11-,15+/m1/s1
InChIKey: InChIKey=GIGKXOAUYMWORB-OSQNNJELSA-N
Formula: C15H22O1
Molecular Weight: 218.33514
Exact Mass: 218.167065
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Xu, Y., Zhang, H.W., Wan, X.C., Zou, Z.M. Magn Reson Chem (2009) 47, 527-31
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Patchoulanes; 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) | 58.7 |
| 2 (CH2) | 41.1 |
| 3 (C) | 210.9 |
| 4 (C) | 133.4 |
| 5 (C) | 181.6 |
| 6 (CH2) | 30.5 |
| 7 (CH) | 45.4 |
| 8 (CH2) | 27 |
| 9 (CH2) | 28.4 |
| 10 (CH) | 33.7 |
| 11 (C) | 41.7 |
| 12 (CH3) | 19.6 |
| 13 (CH3) | 24.8 |
| 14 (CH3) | 16.8 |
| 15 (CH3) | 8.3 |
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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.