Spektraris NMR
Secoinfuscanal
Common Name: Secoinfuscanal
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-10(2)13-8-6-12(4)14(15(13)17)7-5-11(3)9-16/h5,9-10,12-14H,6-8H2,1-4H3/b11-5+/t12-,13+,14+/m1/s1
InChIKey: InChIKey=ANNXGWUSDOUWBS-XMASSBRRSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Nagashima, F., Suzuki, M., Takaoka, S., Asakawa, Y. J Nat Prod (2001) 64, 1309-17
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Miscellanea; 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) | 57.1 |
| 2 (CH2) | 26.2 |
| 3 (CH) | 152.2 |
| 4 (C) | 139.7 |
| 5 (CH) | 194 |
| 6 (C) | 210.2 |
| 7 (CH) | 56.4 |
| 8 (CH2) | 28.8 |
| 9 (CH2) | 34.6 |
| 10 (CH) | 40 |
| 11 (CH) | 26.6 |
| 12 (CH3) | 21.4 |
| 13 (CH3) | 18.9 |
| 14 (CH3) | 20.6 |
| 15 (CH3) | 9.3 |
