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(Decahydro-isoquinolin-3-ylidene)-acetonitrile
SpectraBase Compound ID 3wuCz0jdHh
InChI InChI=1S/C11H16N2/c12-6-5-11-7-9-3-1-2-4-10(9)8-13-11/h5,9-10,13H,1-4,7-8H2/b11-5-
InChIKey HOASIPDGQBODED-WZUFQYTHSA-N
Mol Weight 176.26 g/mol
Molecular Formula C11H16N2
Exact Mass 176.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Pcho3udbF7
Name (Decahydro-isoquinolin-3-ylidene)-acetonitrile
Alternate Name(s) (2Z)-Octahydro-3(2H)-isoquinolinylideneethanenitrile (2Z)-2-(2,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-3-ylidene)acetonitrile
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16N2
InChI InChI=1S/C11H16N2/c12-6-5-11-7-9-3-1-2-4-10(9)8-13-11/h5,9-10,13H,1-4,7-8H2/b11-5-
InChIKey HOASIPDGQBODED-WZUFQYTHSA-N
Molecular Weight 176.263 g/mol
SMILES N1\C(CC2CCCCC2C1)=C/C#N
SPLASH splash10-004i-7900000000-5998a1b1d267bc39f76a
Source of Spectrum CM-1999-21983-0
Wiley ID 484337