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4-Oxo-7-n-propyl-3,4-dihydro-7H-imidazolo[4,5-d]-1,2,3-triazin-N2-oxide
SpectraBase Compound ID Lco0Gzqsh5x
InChI InChI=1S/C7H9N5O2/c1-2-3-11-4-8-5-6(11)9-12(14)10-7(5)13/h4H,2-3H2,1H3,(H,9,10,13)
InChIKey HWYSDMSWDJVBFU-UHFFFAOYSA-N
Mol Weight 195.18 g/mol
Molecular Formula C7H9N5O2
Exact Mass 195.075625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVL58BHQvl0
Name 4-Oxo-7-n-propyl-3,4-dihydro-7H-imidazolo[4,5-d]-1,2,3-triazin-N2-oxide
Alternate Name(s) 7-propyl-3,7-dihydro-4H-imidazo[4,5-d][1,2,3]triazin-4-one 2-oxide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N5O2
InChI InChI=1S/C7H9N5O2/c1-2-3-11-4-8-5-6(11)9-12(14)10-7(5)13/h4H,2-3H2,1H3,(H,9,10,13)
InChIKey HWYSDMSWDJVBFU-UHFFFAOYSA-N
Molecular Weight 195.182 g/mol
SMILES N1C(c2nc[n](c2N=[N+]1[O-])CCC)=O
SPLASH splash10-0006-9100000000-bcf79c069100651f0e37
Source of Spectrum SO-0-520-18
Wiley ID 1540117