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5-Fluoranyl-6-(4-methylpiperazin-1-yl)-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium
SpectraBase Compound ID 2PxBM8hUczt
InChI InChI=1S/C11H13FN4O2/c1-14-2-4-15(5-3-14)10-7-9-11(6-8(10)12)16(17)18-13-9/h6-7H,2-5H2,1H3
InChIKey ZHMWVDCZDJDXKW-UHFFFAOYSA-N
Mol Weight 252.25 g/mol
Molecular Formula C11H13FN4O2
Exact Mass 252.102254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PUzX1dk83V
Name 5-Fluoranyl-6-(4-methylpiperazin-1-yl)-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium
CAS Registry Number 173029-85-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13FN4O2
InChI InChI=1S/C11H13FN4O2/c1-14-2-4-15(5-3-14)10-7-9-11(6-8(10)12)16(17)18-13-9/h6-7H,2-5H2,1H3
InChIKey ZHMWVDCZDJDXKW-UHFFFAOYSA-N
Molecular Weight 252.249 g/mol
SMILES CN1CCN(c2cc3no[n+](c3cc2F)[O-])CC1
SPLASH splash10-0006-9210000000-3f5636925003d2f88408
Synonyms 5-Fluoro-6-(4-methyl-1-piperazinyl)-3-oxido-2,1,3-benzoxadiazol-3-ium 5-Fluoro-6-(4-methylpiperazin-1-yl)-3-oxido-2,1,3-benzoxadiazol-3-ium 6-Fluoro-5-(4-methyl-1-piperazinyl)-2,1,3-benzoxadiazole 1-oxide 6-Fluoro-5-(4-methylpiperazin-1-yl)benzo[1,2,5]oxadiazol-1-oxide 6-Fluoro-5-(4-methylpiperazino)-1-oxido-benzofurazan-1-ium
Wiley ID 1475180