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7,8-dihydro-6H-[1,4]dioxepino[2,3-f][2,1,3]benzoxadiazole 1-oxide
SpectraBase Compound ID Kyy0NMbRgBL
InChI InChI=1S/C9H8N2O4/c12-11-7-5-9-8(4-6(7)10-15-11)13-2-1-3-14-9/h4-5H,1-3H2
InChIKey AVBXZMLGHRJRRL-UHFFFAOYSA-N
Mol Weight 208.17 g/mol
Molecular Formula C9H8N2O4
Exact Mass 208.048407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6RQBW9w7zOs
Name 7,8-Dihydro-6H-[1,4]dioxepino[2,3-f][2,1,3]benzoxadiazole 1-oxide
Alternate Name(s) 3-Oxidanidyl-7,8-dihydro-6H-[1,4]dioxepino[2,3-f][2,1,3]benzoxadiazol-3-ium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O4
InChI InChI=1S/C9H8N2O4/c12-11-7-5-9-8(4-6(7)10-15-11)13-2-1-3-14-9/h4-5H,1-3H2
InChIKey AVBXZMLGHRJRRL-UHFFFAOYSA-N
Molecular Weight 208.173 g/mol
SMILES c12[n+](onc2cc2c(c1)OCCCO2)[O-]
SPLASH splash10-0bvm-9420000000-11ac609c9a2abc16df63
Source of Spectrum O-34-1143-5
Wiley ID 763461