Spektraris NMR
Guaioxide
Common Name: Guaioxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O/c1-10-5-7-12-9-15(16-14(12,3)4)11(2)6-8-13(10)15/h10-13H,5-9H2,1-4H3/t10-,11-,12+,13+,15-/m0/s1
InChIKey: InChIKey=GXMJXGUEPXEOGR-WHPHWUKISA-N
Formula: C15H26O1
Molecular Weight: 222.366903
Exact Mass: 222.198365
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Arantes, S.F., Hanson, J.R. Phytochemistry (1999) 51, 757-60
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Guaianes; 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) | 54.8 |
| 2 (CH2) | 28.5 |
| 3 (CH2) | 31.1 |
| 4 (CH) | 46 |
| 5 (C) | 90.9 |
| 6 (CH2) | 40.8 |
| 7 (CH) | 41.1 |
| 8 (CH2) | 30.4 |
| 9 (CH2) | 33.8 |
| 10 (CH) | 37.5 |
| 11 (C) | 80.9 |
| 12 (CH3) | 30.4 |
| 13 (CH3) | 23 |
| 14 (CH3) | 23.3 |
| 15 (CH3) | 16.3 |
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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.