(±)-cis/trans –1,2,4a,5,6,8a-Hexahydro-8-methoxy-3,4a-dimethylnaphthalene

(±)-cis/trans –1,2,4a,5,6,8a-Hexahydro-8-methoxy-3,4a-dimethylnaphthalene

Common Name: (±)-cis/trans –1,2,4a,5,6,8a-Hexahydro-8-methoxy-3,4a-dimethylnaphthalene

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C13H20O/c1-10-6-7-11-12(14-3)5-4-8-13(11,2)9-10/h5,9,11H,4,6-8H2,1-3H3/t11-,13+/m1/s1

InChIKey: InChIKey=IXJYCBFUXXFSSN-YPMHNXCESA-N

Formula: C13H20O1

Molecular Weight: 192.297787

Exact Mass: 192.151415

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Kraft, P., Weymuth, C., Nussbaumer, C. Eur J Org Chem (2006) 0, 1403-12

Species:

Notes: Family : Aromatics, Type : Naphthalenes; 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) 157.1
2 (CH) 92.2
3 (CH2) 29.2
4 (CH2) 24.9
5 (CH) 132.5
6 (C) 131
7 (CH2) 32.2
8 (CH2) 20.8
9 (CH) 43.3
10 (C) 34.4
1a (CH3) 54
6a (CH3) 23.7
10a (CH3) 26.3