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7-Oxobicyclo[4.2.0]octa-1,3,5-triene-5-carbonitrile
SpectraBase Compound ID FbJunWq9EFz
InChI InChI=1S/C9H5NO/c10-5-7-3-1-2-6-4-8(11)9(6)7/h1-3H,4H2
InChIKey OHBXHQPJLCLKGU-UHFFFAOYSA-N
Mol Weight 143.14 g/mol
Molecular Formula C9H5NO
Exact Mass 143.037114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rYoKk7h4cB
Name 7-Oxobicyclo[4.2.0]octa-1,3,5-triene-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H5NO
InChI InChI=1S/C9H5NO/c10-5-7-3-1-2-6-4-8(11)9(6)7/h1-3H,4H2
InChIKey OHBXHQPJLCLKGU-UHFFFAOYSA-N
Molecular Weight 143.145 g/mol
SMILES C1(c2c(C#N)cccc2C1)=O
SPLASH splash10-014l-2900000000-3e9452c197fdc386a3fc
Source of Spectrum H-81-263-1
Synonyms 7-Oxo-5-bicyclo[4.2.0]octa-1(6),2,4-trienecarbonitrile 7-Oxobicyclo[4.2.0]octa-1(6),2,4-triene-5-carbonitrile 7-Oxidanylidenebicyclo[4.2.0]octa-1(6),2,4-triene-5-carbonitrile
Wiley ID 1141993