Spektraris NMR
Infuscol D
Common Name: Infuscol D
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H26O3/c1-13(2)6-5-7-14(13,3)9-8-10(16)15(4,17)12-11(9)18-12/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11-,12-,14+,15+/m1/s1
InChIKey: InChIKey=WKPUMUUKOQIOFA-GFCMYALRSA-N
Formula: C15H26O3
Molecular Weight: 254.365713
Exact Mass: 254.188195
NMR Solvent: CDCl3
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 : Cuparanes; 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) | 59.3 |
| 2 (CH) | 57 |
| 3 (C) | 67.8 |
| 4 (CH) | 73.3 |
| 5 (CH2) | 25.5 |
| 6 (CH) | 42.3 |
| 7 (C) | 47.9 |
| 8 (CH2) | 39.4 |
| 9 (CH2) | 19.1 |
| 10 (CH2) | 41.7 |
| 11 (C) | 44.1 |
| 12 (CH3) | 25 |
| 13 (CH3) | 24.7 |
| 14 (CH3) | 18.8 |
| 15 (CH3) | 24.4 |
