Spektraris NMR
Dehydrochamaecynone
Common Name: Dehydrochamaecynone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C14H16O/c1-4-11-5-7-14(3)8-6-13(15)10(2)12(14)9-11/h1,6,8,11H,5,7,9H2,2-3H3/t11-,14+/m1/s1
InChIKey: InChIKey=RTESQNRDPLLSCQ-RISCZKNCSA-N
Formula: C14H16O1
Molecular Weight: 200.27676
Exact Mass: 200.120115
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Higuchi, Y., Shimoma, F., Koyanagi, R., Suda, K., Mitsui, T., Kataoka, T., Nagai, K., Ando, M. J Nat Prod (2003) 66, 588-94
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 13 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) | 156.2 |
| 2 (CH) | 126.2 |
| 3 (C) | 186.1 |
| 4 (C) | 130.1 |
| 5 (C) | 156.6 |
| 6 (CH2) | 33.7 |
| 7 (CH) | 30.5 |
| 8 (CH2) | 27.5 |
| 9 (CH2) | 36.8 |
| 10 (C) | 39.7 |
| 11 (C) | 86.6 |
| 12 (CH) | 69.2 |
| 14 (CH3) | 23.4 |
| 15 (CH3) | 10.6 |
