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4-(4-Chloro-benzoyl)-4,5-diaza-spiro[2.4]hept-5-ene-6-carbonitrile
SpectraBase Compound ID 9D9fY05fKFE
InChI InChI=1S/C13H10ClN3O/c14-10-3-1-9(2-4-10)12(18)17-13(5-6-13)7-11(8-15)16-17/h1-4H,5-7H2
InChIKey CEIKQRXNWNGBBL-UHFFFAOYSA-N
Mol Weight 259.7 g/mol
Molecular Formula C13H10ClN3O
Exact Mass 259.05124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gb1YLwTGxbm
Name 4-(4-Chloro-benzoyl)-4,5-diaza-spiro[2.4]hept-5-ene-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10ClN3O
InChI InChI=1S/C13H10ClN3O/c14-10-3-1-9(2-4-10)12(18)17-13(5-6-13)7-11(8-15)16-17/h1-4H,5-7H2
InChIKey CEIKQRXNWNGBBL-UHFFFAOYSA-N
Molecular Weight 259.696 g/mol
SMILES C(#N)C=1CC2(N(N1)C(c1ccc(cc1)Cl)=O)CC2
SPLASH splash10-000i-1910000000-d4b2606e1ca1a7b0ff40
Synonyms 7-(4-Chlorobenzoyl)-6,7-diazaspiro[2.4]hept-5-ene-5-carbonitrile 4-[(4-chlorophenyl)-oxomethyl]-4,5-diazaspiro[2.4]hept-5-ene-6-carbonitrile 4-(4-Chlorophenyl)carbonyl-4,5-diazaspiro[2.4]hept-5-ene-6-carbonitrile
Wiley ID 1458766