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5-nitro-3H-1,3-benzoxazol-2-one
SpectraBase Compound ID JJoNE6uT1nX
InChI InChI=1S/C7H4N2O4/c10-7-8-5-3-4(9(11)12)1-2-6(5)13-7/h1-3H,(H,8,10)
InChIKey UTQPEXLRBRAERQ-UHFFFAOYSA-N
Mol Weight 180.12 g/mol
Molecular Formula C7H4N2O4
Exact Mass 180.017107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5ZlAp8GpaL
Name 5-Nitro-2(3H)-benzoxazolone
Alternate Name(s) 5-Nitro-1,3-benzoxazol-2(3H)-one 5-Nitro-3H-1,3-benzoxazol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4N2O4
InChI InChI=1S/C7H4N2O4/c10-7-8-5-3-4(9(11)12)1-2-6(5)13-7/h1-3H,(H,8,10)
InChIKey UTQPEXLRBRAERQ-UHFFFAOYSA-N
Molecular Weight 180.119 g/mol
SMILES N1c2cc(ccc2OC1=O)N(=O)=O
SPLASH splash10-0f89-5900000000-c563b6bbec9c34890981
Source of Spectrum Y-28-1938-3
Wiley ID 1175731