Spektraris NMR
Verticillol
Common Name: Verticillol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O/c1-15-7-6-8-16(2)10-12-18-19(3,4)17(11-9-15)13-14-20(18,5)21/h8-9,17-18,21H,6-7,10-14H2,1-5H3/b15-9+,16-8+/t17-,18+,20?/m1/s1
InChIKey: InChIKey=CQWSCMMFUZYKBO-YGVQRTPMSA-N
Formula: C20H34O1
Molecular Weight: 290.484108
Exact Mass: 290.260966
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bai, S., Jain, M. Magn Reson Chem (2008) 46, 791-3
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Verticillanes; 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) | 43.3 |
| 2 (CH2) | 34.1 |
| 3 (CH) | 127.7 |
| 4 (C) | 133.1 |
| 5 (CH2) | 41.2 |
| 6 (CH2) | 31.4 |
| 7 (CH) | 129.9 |
| 8 (C) | 133.4 |
| 9 (CH2) | 41.1 |
| 10 (CH2) | 20.6 |
| 11 (CH) | 44.7 |
| 12 (C) | 75.8 |
| 13 (CH2) | 41.3 |
| 14 (CH2) | 28.8 |
| 15 (C) | 37.3 |
| 16 (CH3) | 26 |
| 17 (CH3) | 27.9 |
| 18 (CH3) | 15.3 |
| 19 (CH3) | 15.9 |
| 20 (CH3) | 12.6 |
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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.