Spektraris NMR
Neoliacine
Common Name: Neoliacine
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H14O6/c1-6-5-15-9(7(2)12(16)21-15)10-11-14(20-11,13(17)18-10)4-3-8(6)19-15/h5,8,10-11H,3-4H2,1-2H3/t8-,10-,11+,14-,15-/m1/s1
InChIKey: InChIKey=RRNMDHLOLUUHIK-UJJBCWTCSA-N
Formula: C15H14O6
Molecular Weight: 290.268639
Exact Mass: 290.079038
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Chen, K.S., Chang, F.R., Chiang, M.Y., Wu, Y.C. J Nat Prod (1999) 62, 622-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Germacranes; 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) | 147.24 |
| 2 (CH) | 88.14 |
| 3 (CH2) | 27.19 |
| 4 (CH2) | 18.43 |
| 5 (C) | 55.51 |
| 6 (CH) | 60.29 |
| 7 (CH) | 71.12 |
| 8 (C) | 147.86 |
| 9 (C) | 115.07 |
| 10 (CH) | 122.91 |
| 11 (C) | 132.93 |
| 12 (C) | 169.32 |
| 13 (CH3) | 8.91 |
| 14 (CH3) | 12.28 |
| 15 (C) | 172.06 |
