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5-[(2-Phenyl-1H-benzo[d]imidazol-1-yl)methyl]pyrimidine-2,4,6(1H,3H,5H)-trione
SpectraBase Compound ID LxQ4nBcfEop
InChI InChI=1S/C18H14N4O3/c23-16-12(17(24)21-18(25)20-16)10-22-14-9-5-4-8-13(14)19-15(22)11-6-2-1-3-7-11/h1-9,12H,10H2,(H2,20,21,23,24,25)
InChIKey XVDMVZWSAFENRZ-UHFFFAOYSA-N
Mol Weight 334.33 g/mol
Molecular Formula C18H14N4O3
Exact Mass 334.10659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1oIQpWctHM
Name 5-[(2-Phenyl-1H-benzo[d]imidazol-1-yl)methyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.106590324 u
Formula C18H14N4O3
InChI InChI=1S/C18H14N4O3/c23-16-12(17(24)21-18(25)20-16)10-22-14-9-5-4-8-13(14)19-15(22)11-6-2-1-3-7-11/h1-9,12H,10H2,(H2,20,21,23,24,25)
InChIKey XVDMVZWSAFENRZ-UHFFFAOYSA-N
Instrument Name Shimadzu GC/ MS-QP 2010 plus or Thermo scientific ISQ LT
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202200433
SMILES N1C(NC(C(CN2C(C3=CC=CC=C3)=NC3=C2C=CC=C3)C1=O)=O)=O
SPLASH splash10-052f-9553000000-f3ff203c024344fc824e
Source of Spectrum APC-356-SM10-2c (DOI: 10.1002/ardp.202200433)
Wiley ID 1909790