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3-[5-(Benzylamino)uracil-1-yl]propanenitrile
SpectraBase Compound ID Da36G2rOhBU
InChI InChI=1S/C14H14N4O2/c15-7-4-8-18-10-12(13(19)17-14(18)20)16-9-11-5-2-1-3-6-11/h1-3,5-6,10,16H,4,8-9H2,(H,17,19,20)
InChIKey VJTNDVMYVLMOCS-UHFFFAOYSA-N
Mol Weight 270.29 g/mol
Molecular Formula C14H14N4O2
Exact Mass 270.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yosD308Skv
Name 3-[5-(Benzylamino)uracil-1-yl]propanenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C14H14N4O2
InChI InChI=1S/C14H14N4O2/c15-7-4-8-18-10-12(13(19)17-14(18)20)16-9-11-5-2-1-3-6-11/h1-3,5-6,10,16H,4,8-9H2,(H,17,19,20)
InChIKey VJTNDVMYVLMOCS-UHFFFAOYSA-N
Molecular Weight 270.292 g/mol
SMILES N1C(C(=CN(C1=O)CCC#N)NCc1ccccc1)=O
SPLASH splash10-00di-0090000000-17b09902cbc2dacc4f53
Source of Spectrum F4-43-608-13a
Wiley ID 1675233