Spektraris NMR
β-Oplopenone
Common Name: β-Oplopenone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O/c1-9(2)12-6-5-10(3)13-7-8-14(11(4)16)15(12)13/h9,12-15H,3,5-8H2,1-2,4H3/t12-,13-,14+,15-/m1/s1
InChIKey: InChIKey=YKWVCZPTAAKDIY-APIJFGDWSA-N
Formula: C15H24O1
Molecular Weight: 220.351021
Exact Mass: 220.182715
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Paolini, J., Desjobert, J.M., Muselli, A., Costa, J. Molecules (2008) 13, 1004-10
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Oplopanes; 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) | 51.8 |
| 2 (CH2) | 27.34 |
| 3 (CH2) | 28.48 |
| 4 (C) | 211.71 |
| 5 (CH) | 56.06 |
| 6 (CH) | 52.08 |
| 7 (CH) | 49.26 |
| 8 (CH2) | 26.55 |
| 9 (CH2) | 35.27 |
| 10 (C) | 150.86 |
| 11 (CH) | 29.58 |
| 12 (CH3) | 21.93 |
| 13 (CH3) | 15.66 |
| 14 (CH2) | 103.52 |
| 15 (CH3) | 28.87 |
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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.