Spektraris NMR
Valerena-4,7(11)-diene
Common Name: Valerena-4,7(11)-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24/c1-10(2)9-13-7-5-11(3)14-8-6-12(4)15(13)14/h9,11,13-14H,5-8H2,1-4H3/t11-,13+,14-/m1/s1
InChIKey: InChIKey=MZZFDMZYIBWOOA-KWCYVHTRSA-N
Formula: C15H24
Molecular Weight: 204.351617
Exact Mass: 204.187801
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Paul, C., Konig, W.A., Muhle, H. Phytochemistry (2001) 57, 307-13
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Valeranes; 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) | 47.4 |
| 2 (CH2) | 24.6 |
| 3 (CH2) | 37.55 |
| 4 (C) | 128.38 |
| 5 (C) | 136.04 |
| 6 (CH) | 33.65 |
| 7 (CH) | 126.21 |
| 8 (CH2) | 26.56 |
| 9 (CH2) | 28.69 |
| 10 (CH) | 33.57 |
| 11 (C) | 129.77 |
| 12 (CH3) | 17.78 |
| 13 (CH3) | 26.11 |
| 14 (CH3) | 12.07 |
| 15 (CH3) | 13.39 |
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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.