Spektraris NMR
Sigmosceptrellin
Common Name: Sigmosceptrellin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H28O/c1-12(2)8-6-10-14(5,15)11-7-9-13(3)4/h8,13,15H,6-7,9-11H2,1-5H3
InChIKey: InChIKey=OFSWGVNKPXHFFL-UHFFFAOYSA-N
Formula: C14H28O1
Molecular Weight: 212.372049
Exact Mass: 212.214016
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ovenden, S.P.B., Capon, R.J. J Nat Prod (1999) 62, 214-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Farnesanes; 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 |
|---|---|
| 2 (CH3) | 27.9 |
| 3 (C) | 131.4 |
| 4 (CH) | 124.5 |
| 5 (CH2) | 42.1 |
| 6 (CH2) | 41.5 |
| 7 (C) | 72.7 |
| 8 (CH2) | 39.5 |
| 9 (CH2) | 21.6 |
| 10 (CH2) | 22.6 |
| 11 (CH) | 22.5 |
| 12 (CH3) | 26.8 |
| 13 (CH3) | 22.6 |
| 14 (CH3) | 25.6 |
| 15 (CH3) | 17.5 |
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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.