Spektraris NMR
ainigmaptilones A
Common Name: ainigmaptilones A
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O2/c1-10(2)12-4-6-15(9-16)7-5-14(17)11(3)13(15)8-12/h5,7,11-13,16H,1,4,6,8-9H2,2-3H3/t11-,12+,13+,15+/m0/s1
InChIKey: InChIKey=YTUPFINPNGTNSF-KYEXWDHISA-N
Formula: C15H22O2
Molecular Weight: 234.334545
Exact Mass: 234.16198
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Iken, K.B., Baker, B.J. J Nat Prod (2003) 66, 888-90
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 13 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) | 162.9 |
| 2 (CH) | 128.1 |
| 3 (C) | 205.8 |
| 4 (CH) | 45.9 |
| 5 (CH) | 40.8 |
| 6 (CH2) | 28 |
| 7 (CH) | 39.9 |
| 8 (CH2) | 24.5 |
| 9 (CH2) | 29.6 |
| 10 (C) | 43.5 |
| 11 (C) | 147.9 |
| 12 (CH2) | 111.8 |
| 13 (CH3) | 23.1 |
| 14 (CH2) | 65 |
| 15 (CH3) | 14.6 |
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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.