Spektraris NMR
Tomentosin
Common Name: Tomentosin
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H20O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h6,9,13-14H,3-5,7-8H2,1-2H3/t9-,13+,14+/m0/s1
InChIKey: InChIKey=AVFIYMSJDDGDBQ-CUOATXAZSA-N
Formula: C15H20O3
Molecular Weight: 248.318068
Exact Mass: 248.141245
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Fontana, G., La Rocca, S., Passannanti, S., Paternostro, M.P. Nat Prod Res (2007) 21, 824-7
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Xanthanes; 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) | 144.5 |
| 2 (CH2) | 30.4 |
| 3 (CH2) | 42.6 |
| 4 (C) | 207.9 |
| 5 (CH) | 120 |
| 6 (CH2) | 26.6 |
| 7 (CH) | 42.1 |
| 8 (CH) | 79.2 |
| 9 (CH2) | 36.7 |
| 10 (CH) | 35.5 |
| 11 (C) | 139 |
| 12 (C) | 170.1 |
| 13 (CH2) | 122 |
| 14 (CH3) | 20.1 |
| 15 (CH3) | 29.9 |
