Spektraris NMR
Trichocarane C
Common Name: Trichocarane C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H28O3/c1-10(2)15(18)12-5-4-11(9-16)6-7-14(12,3)8-13(15)17/h10-13,16-18H,4-9H2,1-3H3/t11?,12-,13+,14+,15-/m1/s1
InChIKey: InChIKey=WTQQWFFTXHFCPX-KIAMUWECSA-N
Formula: C15H28O3
Molecular Weight: 256.381594
Exact Mass: 256.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Macias, F.A., Varela, R.M., Simonet, A.M., Cutler, H.G., Cutler, S.J., Eden, M.A., Hill, R.A. J Nat Prod (2000) 63, 1197-200
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Daucanes; 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) | 43.9 |
| 2 (CH2) | 51.6 |
| 3 (CH) | 72.6 |
| 4 (C) | 83.9 |
| 5 (CH) | 55.5 |
| 6 (CH2) | 22.9 |
| 7 (CH2) | 30.1 |
| 8 (CH) | 41.5 |
| 9 (CH2) | 27.2 |
| 10 (CH2) | 39.9 |
| 11 (CH) | 35.1 |
| 12 (CH3) | 17 |
| 13 (CH3) | 17.7 |
| 14 (CH2) | 68.9 |
| 15 (CH3) | 23.8 |
