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Bicyclo[2.2.2]octa-2,5-diene-2-carbonitrile
SpectraBase Compound ID Ev7q9s19MoG
InChI InChI=1S/C9H9N/c10-6-9-5-7-1-3-8(9)4-2-7/h1,3,5,7-8H,2,4H2/t7-,8+/m1/s1
InChIKey ZEKPAKWFJGJPSB-SFYZADRCSA-N
Mol Weight 131.18 g/mol
Molecular Formula C9H9N
Exact Mass 131.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Q62z9fTdhL
Name Bicyclo[2.2.2]octa-2,5-diene-2-carbonitrile
CAS Registry Number 39863-23-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N
InChI InChI=1S/C9H9N/c10-6-9-5-7-1-3-8(9)4-2-7/h1,3,5,7-8H,2,4H2/t7-,8+/m1/s1
InChIKey ZEKPAKWFJGJPSB-SFYZADRCSA-N
Molecular Weight 131.178 g/mol
SMILES C1(=C[C@@]2(C=C[C@]1(CC2)[H])[H])C#N
SPLASH splash10-0udi-9800000000-537484ac2d32addfec6e
Synonyms 3-bicyclo[2.2.2]octa-2,5-dienecarbonitrile bicyclo[2.2.2]octa-2,5-diene-3-carbonitrile
Wiley ID 1475514