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5-[(1H-benzo[d]imidazol-1-yl)methyl]pyrimidine-2,4,6(1H,3H,5H)-trione
SpectraBase Compound ID JPjgeKFxxDx
InChI InChI=1S/C12H10N4O3/c17-10-7(11(18)15-12(19)14-10)5-16-6-13-8-3-1-2-4-9(8)16/h1-4,6-7H,5H2,(H2,14,15,17,18,19)
InChIKey HHHIAKQFQBGGPF-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C12H10N4O3
Exact Mass 258.07529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BR2nJrqDkOJ
Name 5-[(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 258.075290195 u
Formula C12H10N4O3
InChI InChI=1S/C12H10N4O3/c17-10-7(11(18)15-12(19)14-10)5-16-6-13-8-3-1-2-4-9(8)16/h1-4,6-7H,5H2,(H2,14,15,17,18,19)
InChIKey HHHIAKQFQBGGPF-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
Molecular Weight 258.237 g/mol
SMILES N1C(NC(C(CN2C=NC=3C=CC=CC23)C1=O)=O)=O
SPLASH splash10-00ec-3920000000-ec944d1a52e281c13e75
Source of Spectrum APC-356-SM4-2a (DOI: 10.1002/ardp.202200433)
Wiley ID 1909788