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7-Chloranylbicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile

View entire compound with spectra: 1 MS (GC)

7-Chloranylbicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile
SpectraBase Compound ID GfhTcZIg5O6
InChI InChI=1S/C9H6ClN/c10-9(6-11)5-7-3-1-2-4-8(7)9/h1-4H,5H2
InChIKey ANKHHWJCRCJNAV-UHFFFAOYSA-N
Mol Weight 163.61 g/mol
Molecular Formula C9H6ClN
Exact Mass 163.018877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EkpLmcmwNxd
Name 7-Chloranylbicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile
Alternate Name(s) 7-Chloro-7-bicyclo[4.2.0]octa-1,3,5-trienecarbonitrile 7-Chlorobicyclo[4.2.0]octa-1,3,5-triene-7-carbonitrile
CAS Registry Number 68913-19-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6ClN
InChI InChI=1S/C9H6ClN/c10-9(6-11)5-7-3-1-2-4-8(7)9/h1-4H,5H2
InChIKey ANKHHWJCRCJNAV-UHFFFAOYSA-N
Molecular Weight 163.607 g/mol
SMILES C1(c2ccccc2C1)(C#N)Cl
SPLASH splash10-004i-0900000000-1aa1f3d56a7632a130ab
Source of Spectrum B-31-2011-0
Wiley ID 1159405