For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

[2S-(2-ALPHA-(S*)-3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-DODECANITRILE

Compound with spectra: 1 NMR

[2S-(2-ALPHA-(S*)-3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-DODECANITRILE
SpectraBase Compound ID CB0aNAS6wVZ
InChI InChI=1S/C24H41NO2/c1-5-6-7-8-9-10-11-12-13-18(17-25)26-21-16-19-20-14-15-24(4,22(19)27-21)23(20,2)3/h18-22H,5-16H2,1-4H3/t18?,19-,20-,21-,22-,24+/m1/s1
InChIKey MEGADWBSOYXWBI-HIKJLANFSA-N
Mol Weight 375.6 g/mol
Molecular Formula C24H41NO2
Exact Mass 375.31373 g/mol
Enantiomer InChIKey MEGADWBSOYXWBI-YQOFCYSLSA-N

View Spectrum of [2S-(2-ALPHA-(S*)-3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-DODECANITRILE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
(R)-O-MBF-2-HYDROXYDODECANNITRILE
(S)-O-MBE-2-HYDROXYDODECANNITRILE
[2S-(2-ALPHA(R*),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURAN-2-YL)-OXY]-BUTANNITRILE
[2R-(2-ALPHA(R*),3A-ALPHA,4-ALPHA,7-ALPHA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YL)-OXY]-BUTANENITRILE
[2R-(2-ALPHA(R*),3A-ALPHA,4-ALPHA,7-ALPHA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YL)-OXY]-3-(PHENYLMETHOXY)-PROPANENITRILE
[2R-(2-ALPHA(R*),3A-ALPHA,4-ALPHA,7-ALPHA,7A-ALPHA)]-2-[(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE-2-YL)-OXY]-BUTANALE
2,2'-Oxy-bis(octahydro-7,8,8-trimethyl-4,7-methano-benzofuran) diastereomer B
[2S-[2-ALPHA-(2R*,3A'S*,4'S*,7'S*,7A'S*),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA]]-2,2'-OXYBIS-(OCTAHYDRO-7,8,8-TRIMETHYL-4,7-METHANOBENZOFURANE)
#1B;[2R,2'R-(2-ALPHA,2'-ALPHA,3A-ALPHA,3A'-ALPHA,4-ALPHA,4'-ALPHA,7-ALPHA,7'-ALPHA,7A-ALPHA,7A'-ALPHA)-[2,2'-OXYBIS-(2,3,3A,4,5,6,7,7A-OCTAHYDRO-7,8,8-TRIMETHY
2,2'-Oxy-bis(octahydro-7,8,8-trimethyl-4,7-methano-benzofuran) diastereomer A
Title Journal or Book Year
Pheromone, 1. Mitt.: (+)-cis-Disparlure: Synthese und Feldtests Monatshefte f�r Chemie Chemical Monthly 1991
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.