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Nicaeensin
SpectraBase Compound ID JHQP4ytrGTd
InChI InChI=1S/C9H19N5O2/c1-7(15)14(2)6-4-3-5-12-9(16)13-8(10)11/h3-6H2,1-2H3,(H5,10,11,12,13,16)
InChIKey WPFZNRDJPZPUPO-UHFFFAOYSA-N
Mol Weight 229.28 g/mol
Molecular Formula C9H19N5O2
Exact Mass 229.153875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ijhJoIzYaF
Name Nicaeensin
Alternate Name(s) 1-(3'-Amidoureido)-4-(N-methylacetamido)-butane N-[4-[[(diaminomethylideneamino)-oxomethyl]amino]butyl]-N-methylacetamide N-[4-(diaminomethylidenecarbamoylamino)butyl]-N-methylacetamide N-[4-[bis(azanyl)methylidenecarbamoylamino]butyl]-N-methyl-ethanamide
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Formula C9H19N5O2
InChI InChI=1S/C9H19N5O2/c1-7(15)14(2)6-4-3-5-12-9(16)13-8(10)11/h3-6H2,1-2H3,(H5,10,11,12,13,16)
InChIKey WPFZNRDJPZPUPO-UHFFFAOYSA-N
Molecular Weight 229.284 g/mol
SMILES N(C(=N)N)C(=O)NCCCCN(C(=O)C)C
SPLASH splash10-0006-9100000000-5bfd6b19769a7f2adda0
Source of Spectrum X2-53-1222-1
Wiley ID 1603715