Spektraris NMR
14-Hydroxysantonin
Common Name: 14-Hydroxysantonin
Synonyms: 14-Hydroxysantonin
CAS Registry Number:
InChI: InChI=1S/C15H18O4/c1-8-9-3-5-15(2)6-4-11(17)10(7-16)12(15)13(9)19-14(8)18/h4,6,8-9,13,16H,3,5,7H2,1-2H3/t8-,9-,13-,15-/m0/s1
InChIKey: InChIKey=VSGQVARJVVXBHW-CMHQFQFSSA-N
Formula: C15H18O4
Molecular Weight: 262.301592
Exact Mass: 262.120509
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Yang, L., Dai, J., Sakai, J.I., Ando, M. J Asian Nat Prod Res (2006) 8, 317-26
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 155.51 |
| 2 (CH) | 126.2 |
| 3 (C) | 194.24 |
| 4 (C) | 131.62 |
| 5 (C) | 153.7 |
| 6 (CH) | 80.9 |
| 7 (CH) | 53.55 |
| 8 (CH2) | 22.98 |
| 9 (CH2) | 37.82 |
| 10 (C) | 41.63 |
| 11 (CH) | 41.04 |
| 12 (C) | 176.65 |
| 13 (CH3) | 12.49 |
| 14 (CH3) | 25.3 |
| 15 (CH2) | 56.06 |
