Spektraris NMR
Tsangane I
Common Name: Tsangane I
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H22O3/c1-10(15)6-7-11(16)14(4)9-5-8-13(2,3)12(14)17/h5-9H2,1-4H3/t14-/m0/s1
InChIKey: InChIKey=DBKNAIYCSLWFQM-AWEZNQCLSA-N
Formula: C14H22O3
Molecular Weight: 238.323214
Exact Mass: 238.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Brown, G.D. Tetrahedron (1999) 55, 759-70
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Allohimachalanes; 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) | 62.4 |
| 2 (C) | 206.9 |
| 3 (CH2) | 32 |
| 4 (CH2) | 37 |
| 5 (C) | 206.9 |
| 7 (C) | 214.5 |
| 8 (C) | 46.2 |
| 9 (CH2) | 39.9 |
| 10 (CH2) | 18.3 |
| 11 (CH2) | 35.2 |
| 12 (CH3) | 26 |
| 13 (CH3) | 26.8 |
| 14 (CH3) | 24 |
| 15 (CH3) | 30 |
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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.