Spektraris NMR
Strobilol H
Common Name: Strobilol H
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H18O3/c1-9-4-5-12-10(2)7-14(16)15(17,13(12)6-9)11(3)8-18-14/h4-6,10,16-17H,3,7-8H2,1-2H3/t10-,14+,15+/m1/s1
InChIKey: InChIKey=KJHFPNBMMGJHEB-ONERCXAPSA-N
Formula: C15H18O3
Molecular Weight: 246.302187
Exact Mass: 246.125594
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hiramatsu, F., Murayama, T., Koseki, T., Okada, K., Shiono, Y. Helv Chim Acta (2008) 91, 1595-603
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Calamenenes; 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 (C) | 137.6 |
| 2 (CH) | 127.9 |
| 3 (CH) | 129.3 |
| 4 (C) | 135.9 |
| 5 (CH) | 128.6 |
| 6 (C) | 134.4 |
| 7 (C) | 77.5 |
| 8 (C) | 103.1 |
| 9 (CH2) | 37.1 |
| 10 (CH) | 31.4 |
| 11 (C) | 150.7 |
| 12 (CH2) | 108.7 |
| 13 (CH2) | 67.3 |
| 14 (CH3) | 21 |
| 15 (CH3) | 22.9 |
