Spektraris NMR
7-Formamido-7,8-dihydro-a-bisabolane
Common Name: 7-Formamido-7,8-dihydro-a-bisabolane
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C16H27NO/c1-13(2)6-5-11-16(4,17-12-18)15-9-7-14(3)8-10-15/h6-7,12,15H,5,8-11H2,1-4H3,(H,17,18)/t15-,16-/m0/s1
InChIKey: InChIKey=IDWULDRBNICSKT-HOTGVXAUSA-N
Formula: C16H27N1O1
Molecular Weight: 249.392323
Exact Mass: 249.209264
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Li, Z.Y., Yu, Z.G., Guo, Y.W. Helv Chim Acta (2008) 91, 1553-8
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Bisabolanes; 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 (CH2) | 26.3 |
| 2 (CH) | 119.9 |
| 3 (C) | 134 |
| 4 (CH2) | 30.9 |
| 5 (CH2) | 21.9 |
| 6 (CH) | 40.7 |
| 7 (C) | 57.6 |
| 8 (CH2) | 36.2 |
| 9 (CH2) | 23.3 |
| 10 (CH) | 123.3 |
| 11 (C) | 131.7 |
| 12 (CH3) | 17.7 |
| 13 (CH3) | 25.7 |
| 14 (CH3) | 20.7 |
| 15 (CH3) | 23.2 |
| 7a (CH) | 160.3 |
