Spektraris NMR
Multifolone
Common Name: Multifolone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O4/c1-11-8-14-13(18(14,3)4)6-7-19(5,23)10-15-16(21)12(2)9-20(15,24)17(11)22/h9-11,13-14,17,22-24H,6-8H2,1-5H3/b15-10-/t11-,13+,14-,17+,19-,20-/m1/s1
InChIKey: InChIKey=CZUBZNDQQZRXMB-IUPMFMHCSA-N
Formula: C20H30O4
Molecular Weight: 334.45056
Exact Mass: 334.214409
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Das, B., Ravinkanth, B., Reddy, K.R., Thirupathi, P., Raju, T.V., Sridhar, B. Phytochemistry (2008) 69, 2639-41
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Lathyranes; 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) | 155.7 |
| 2 (C) | 143.6 |
| 3 (C) | 195.5 |
| 4 (C) | 137.4 |
| 5 (CH) | 141.9 |
| 6 (C) | 74.9 |
| 7 (CH2) | 42.9 |
| 8 (CH2) | 20.5 |
| 9 (CH) | 26 |
| 10 (C) | 17.3 |
| 11 (CH) | 21.5 |
| 12 (CH2) | 24.9 |
| 13 (CH) | 30.5 |
| 14 (CH) | 81.5 |
| 15 (C) | 79.3 |
| 16 (CH3) | 10.5 |
| 17 (CH3) | 29.5 |
| 18 (CH3) | 28.7 |
| 19 (CH3) | 14.5 |
| 20 (CH3) | 21.3 |
