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5-Nitrocytosine
SpectraBase Compound ID DCdRWjBBSV5
InChI InChI=1S/C4H4N4O3/c5-3-2(8(10)11)1-6-4(9)7-3/h1H,(H3,5,6,7,9)
InChIKey SPDBZGFVYQCVIU-UHFFFAOYSA-N
Mol Weight 156.1 g/mol
Molecular Formula C4H4N4O3
Exact Mass 156.02834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rVwfZ95ybJ
Name 5-Nitrocytosine
Alternate Name(s) 4-Amino-5-nitro-2(1H)-pyrimidinone 6-Azanyl-5-nitro-1H-pyrimidin-2-one
CAS Registry Number 69099-99-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H4N4O3
InChI InChI=1S/C4H4N4O3/c5-3-2(8(10)11)1-6-4(9)7-3/h1H,(H3,5,6,7,9)
InChIKey SPDBZGFVYQCVIU-UHFFFAOYSA-N
Molecular Weight 156.101 g/mol
SMILES N1C(N=C(C(=C1)N(=O)=O)N)=O
SPLASH splash10-0a4l-9400000000-f8021b0394d7c1ef34d5
Source of Spectrum NP-17-2779-0
Wiley ID 1099463