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3-Cyano-4-azahomoadamantane
SpectraBase Compound ID IY8qhDWg0xu
InChI InChI=1S/C11H16N2/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-13-11/h8-10,13H,1-6H2/t8-,9+,10-,11+
InChIKey BTBZKZDLVNGHNQ-DTIDVZRVSA-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 APAvX07djtK
Name 3-Cyano-4-azahomoadamantane
CAS Registry Number 78837-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16N2
InChI InChI=1S/C11H16N2/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-13-11/h8-10,13H,1-6H2/t8-,9+,10-,11+
InChIKey BTBZKZDLVNGHNQ-DTIDVZRVSA-N
Molecular Weight 176.263 g/mol
SMILES N1C[C@]2(C[C@]3(C[C@]1(C#N)C[C@@](C2)(C3)[H])[H])[H]
SPLASH splash10-017i-3900000000-39264e5b663c3f9f754f
Source of Spectrum J-46-4476-0
Synonyms 3-Azatricyclo[4.3.1.1(3,8)]undecane-4-carbonitrile
Wiley ID 1172562