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5-[(1H-Benzo[d]imidazol-1-yl)methylene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
SpectraBase Compound ID FdAvdSke82W
InChI InChI=1S/C12H8N4O2S/c17-10-7(11(18)15-12(19)14-10)5-16-6-13-8-3-1-2-4-9(8)16/h1-6H,(H2,14,15,17,18,19)
InChIKey GUICALVAXYNQTF-UHFFFAOYSA-N
Mol Weight 272.28 g/mol
Molecular Formula C12H8N4O2S
Exact Mass 272.036797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdIQx0nKlDV
Name 5-[(1H-Benzo[d]imidazol-1-yl)methylene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.036796686 u
Formula C12H8N4O2S
InChI InChI=1S/C12H8N4O2S/c17-10-7(11(18)15-12(19)14-10)5-16-6-13-8-3-1-2-4-9(8)16/h1-6H,(H2,14,15,17,18,19)
InChIKey GUICALVAXYNQTF-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 272.282 g/mol
SMILES N1C(NC(C(=CN2C=NC=3C=CC=CC23)C1=O)=O)=S
SPLASH splash10-07vi-9360000000-5d3f0ae559e891d23bdb
Source of Spectrum APC-356-SM29-3d (DOI: 10.1002/ardp.202200433)
Wiley ID 1909797