Spektraris NMR
Eremophilenone lactam
Common Name: Eremophilenone lactam
Synonyms: Eremophilenone lactam
CAS Registry Number:
InChI: InChI=1S/C16H21NO3/c1-9-12-8-15(3)10(2)13(18)6-5-11(15)7-16(12,20-4)17-14(9)19/h5-6,10-11H,7-8H2,1-4H3,(H,17,19)/t10-,11-,15+,16-/m0/s1
InChIKey: InChIKey=WVEFQNOWFOGYOJ-QMMBQJITSA-N
Formula: C16H21N1O3
Molecular Weight: 275.343488
Exact Mass: 275.152144
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Torres, P., Ayala, J., Grande, C., Anaya, J., Grande, M. Phytochemistry (1999) 52, 1507-13
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 149.9 |
| 2 (CH) | 129.6 |
| 3 (C) | 200.3 |
| 4 (CH) | 42.6 |
| 5 (C) | 44.1 |
| 6 (CH2) | 35.7 |
| 7 (C) | 149.4 |
| 8 (C) | 88.4 |
| 9 (CH2) | 39.5 |
| 10 (CH) | 54.2 |
| 11 (C) | 131.1 |
| 12 (C) | 172.3 |
| 13 (CH3) | 8 |
| 14 (CH3) | 10.8 |
| 15 (CH3) | 7.2 |
| 8a (CH3) | 49.5 |
