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1-Propyl-5-cyano-1H-benzimidazole-2-(para - benzoic) Acid
SpectraBase Compound ID AQbwFmKfZBL
InChI InChI=1S/C18H15N3O2/c1-2-9-21-16-8-3-12(11-19)10-15(16)20-17(21)13-4-6-14(7-5-13)18(22)23/h3-8,10H,2,9H2,1H3,(H,22,23)
InChIKey GXDIIUXJJJMNEH-UHFFFAOYSA-N
Mol Weight 305.34 g/mol
Molecular Formula C18H15N3O2
Exact Mass 305.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H0vyO8X6rmd
Name 1-Propyl-5-cyano-1H-benzimidazole-2-(para - benzoic) Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N3O2
InChI InChI=1S/C18H15N3O2/c1-2-9-21-16-8-3-12(11-19)10-15(16)20-17(21)13-4-6-14(7-5-13)18(22)23/h3-8,10H,2,9H2,1H3,(H,22,23)
InChIKey GXDIIUXJJJMNEH-UHFFFAOYSA-N
Literature Reference DOI 10.1002_1521-4184(200105)334_5_148
Molecular Weight 305.337 g/mol
SMILES OC(c1ccc(cc1)-c1nc2cc(ccc2[n]1CCC)C#N)=O
SPLASH splash10-052f-9212000000-a7c9f1a055fae6a95cee
Source of Spectrum APP-334-151-13
Synonyms 4-(5-cyano-1-propyl-2-benzimidazolyl)benzoic acid 4-(5-cyano-1-propylbenzimidazol-2-yl)benzoic acid 4-(5-cyano-1-propyl-1H-benzo[d]imidazol-2-yl)benzoic acid
Wiley ID 1770553