Common Name: (±)-(E/Z)-4-[(2'',4''-Dimethylcyclohex-3''-enylidene)methyl]-morpholine
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C13H21NO/c1-11-3-4-13(12(2)9-11)10-14-5-7-15-8-6-14/h9-10,12H,3-8H2,1-2H3/b13-10-
InChIKey: InChIKey=WGGSKHPAAWFWHC-RAXLEYEMSA-N
Formula: C13H21N1O1
Molecular Weight: 207.312471
Exact Mass: 207.162314
NMR Solvent: C+C
MHz:
Calibration:
NMR references: 13C - Kraft, P., Weymuth, C., Nussbaumer, C. Eur J Org Chem (2006) 0, 1403-12
Species:
Notes: Family : Aliphatics, Type : Cycloalkanes; 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)
Position | PPM |
---|---|
1 (C) | 132.9 |
2 (CH) | 35.6 |
3 (CH) | 127.1 |
4 (C) | 133.5 |
5 (CH2) | 32.5 |
6 (CH2) | 26.4 |
1' (CH) | 132.8 |
3' (CH2) | 53.7 |
4' (CH2) | 66.8 |
6' (CH2) | 66.8 |
7' (CH2) | 53.7 |
2a (CH3) | 22.3 |
4a (CH3) | 23.5 |