Spektraris NMR
Pacifigorgia-2(10),11-diene
Common Name: Pacifigorgia-2(10),11-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24/c1-10(2)9-15-12(4)5-7-13-11(3)6-8-14(13)15/h9,11-14H,1,5-8H2,2-4H3/b15-9-/t11-,12-,13-,14+/m0/s1
InChIKey: InChIKey=LOWXYGTWKXWTGY-KBJJDSDRSA-N
Formula: C15H24
Molecular Weight: 204.351617
Exact Mass: 204.187801
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Paul, C., Konig, W.A., Muhle, H. Phytochemistry (2001) 57, 307-13
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Pacifigorgianes; 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) | 52.62 |
| 2 (C) | 145.66 |
| 3 (CH) | 39.57 |
| 4 (CH2) | 37.84 |
| 5 (CH2) | 31.22 |
| 6 (CH) | 56.55 |
| 7 (CH) | 39.43 |
| 8 (CH2) | 32.57 |
| 9 (CH2) | 29.83 |
| 10 (CH) | 121.62 |
| 11 (C) | 144.37 |
| 12 (CH2) | 133.71 |
| 13 (CH3) | 24.99 |
| 14 (CH3) | 19.38 |
| 15 (CH3) | 19.76 |
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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.