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3-Cyano-1-(4,5-dihydro-1H-imidazol-2-yl)-1,3-dihydrobenzimidazole-2-one
SpectraBase Compound ID 9H2uXVkx3TN
InChI InChI=1S/C11H9N5O/c12-7-15-8-3-1-2-4-9(8)16(11(15)17)10-13-5-6-14-10/h1-4H,5-6H2,(H,13,14)
InChIKey BCZHTWBPLXOSIL-UHFFFAOYSA-N
Mol Weight 227.23 g/mol
Molecular Formula C11H9N5O
Exact Mass 227.08071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhDDPf89jll
Name 3-Cyano-1-(4,5-dihydro-1H-imidazol-2-yl)-1,3-dihydrobenzimidazole-2-one
Alternate Name(s) 1-Cyano-3-(4,5-dihydro-1H-imidazol-2-yl)-1,3-dihydro-2H-benzimidazol-2-one 3-(4,5-dihydro-1H-imidazol-2-yl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazole-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N5O
InChI InChI=1S/C11H9N5O/c12-7-15-8-3-1-2-4-9(8)16(11(15)17)10-13-5-6-14-10/h1-4H,5-6H2,(H,13,14)
InChIKey BCZHTWBPLXOSIL-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-4184(199807)331_7-8_241
Molecular Weight 227.227 g/mol
SMILES N1C(=NCC1)N1C(N(c2c1cccc2)C#N)=O
SPLASH splash10-004i-0390000000-2c3d6d6c2e2464417740
Source of Spectrum APP-331-245-2a
Wiley ID 1770274