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8-nitro-6-phenyl-1H-4,1,5-benzoxadiazocin-2(3H)-one
SpectraBase Compound ID BFfv3UJlv4l
InChI InChI=1S/C15H11N3O4/c19-14-9-22-17-15(10-4-2-1-3-5-10)12-8-11(18(20)21)6-7-13(12)16-14/h1-8H,9H2,(H,16,19)/b17-15-
InChIKey CMSJOMJKLATPDR-ICFOKQHNSA-N
Mol Weight 297.27 g/mol
Molecular Formula C15H11N3O4
Exact Mass 297.074956 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 8OxjYI2esHz
Name 8-NITRO-6-PHENYL-1H-4,1,5-BENZOXADIAZOCIN-2(3H)-ONE
Source of Sample L. H. Sternbach, Hoffmann-La Roche Inc., Nutley, New Jersey
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11N3O4
InChI InChI=1S/C15H11N3O4/c19-14-9-22-17-15(10-4-2-1-3-5-10)12-8-11(18(20)21)6-7-13(12)16-14/h1-8H,9H2,(H,16,19)/b17-15-
InChIKey CMSJOMJKLATPDR-ICFOKQHNSA-N
Literature Reference JOCE 32, 2417(1967)
Melting Point 253-255C
Molecular Weight 297.269989
Synonyms BENZOXADIAZOCIN-2/3H/-ONE, 1H- 4,1,5-, 8-NITRO-6-PHENYL-,
Technique KBr WAFER