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1-(1H-benzimidazol-2-yl)-3-ethyl-2-isopropyl-isourea
SpectraBase Compound ID 9DTVWvqWhG1
InChI InChI=1S/C13H18N4O/c1-4-14-13(18-9(2)3)17-12-15-10-7-5-6-8-11(10)16-12/h5-9H,4H2,1-3H3,(H2,14,15,16,17)
InChIKey CSADADRWWZAVSP-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C13H18N4O
Exact Mass 246.148061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9msNiu2eHbB
Name 1-(1H-benzimidazol-2-yl)-3-ethyl-2-isopropyl-isourea
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N4O
InChI InChI=1S/C13H18N4O/c1-4-14-13(18-9(2)3)17-12-15-10-7-5-6-8-11(10)16-12/h5-9H,4H2,1-3H3,(H2,14,15,16,17)
InChIKey CSADADRWWZAVSP-UHFFFAOYSA-N
Molecular Weight 246.314 g/mol
SMILES N(\C(=N/c1nc2ccccc2[nH]1)OC(C)C)CC
SPLASH splash10-0bt9-0910000000-6777cffab14e7a665833
Source of Spectrum Y-38-439-5
Synonyms N-(1H-benzimidazol-2-yl)-N'-ethylcarbamimidic acid propan-2-yl ester Propan-2-yl N-(1H-benzimidazol-2-yl)-N'-ethyl-carbamimidate
Wiley ID 848415