Spektraris NMR
Pellialactone
Common Name: Pellialactone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H26O3/c1-12(11-20)9-15(16-10-14(3)18(21)22-16)17-13(2)7-6-8-19(17,4)5/h9-11,15-16H,6-8H2,1-5H3/b12-9+/t15-,16+/m0/s1
InChIKey: InChIKey=VIJGCIHLYOSADX-HUXQLNKYSA-N
Formula: C19H26O3
Molecular Weight: 302.408656
Exact Mass: 302.188195
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Cullmann, F., Becker, H. Phytochemistry (1998) 47, 237-45
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Miscellanea; 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) | 35.8 |
| 2 (CH2) | 39.8 |
| 3 (CH2) | 19.1 |
| 4 (CH2) | 34.4 |
| 5 (C) | 132.4 |
| 6 (C) | 134.6 |
| 7 (CH) | 45.6 |
| 8 (CH) | 151 |
| 9 (C) | 140.9 |
| 10 (CH) | 195.2 |
| 11 (CH) | 82.5 |
| 12 (CH) | 147.8 |
| 13 (C) | 130.6 |
| 14 (C) | 173.4 |
| 15 (CH3) | 10.6 |
| 16 (CH3) | 9.9 |
| 17 (CH3) | 22.2 |
| 18 (CH3) | 28.6 |
| 19 (CH3) | 28.2 |
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The Spektraris NMR database is developed and hosted by the Lange laboratory at WSU. CAS Registry Number is a Registered Trademark of the American Chemical Society.