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6-Nitro-2-benzoxazolinone
SpectraBase Compound ID 5bJe3RmDyri
InChI InChI=1S/C7H4N2O4/c10-7-8-5-2-1-4(9(11)12)3-6(5)13-7/h1-3H,(H,8,10)
InChIKey JGYJZHYTADCWIK-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 Ea8acMTOIjP
Name 6-Nitrobenzo[d]oxazol-2(3H)-one
CAS Registry Number 4694-91-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4N2O4
InChI InChI=1S/C7H4N2O4/c10-7-8-5-2-1-4(9(11)12)3-6(5)13-7/h1-3H,(H,8,10)
InChIKey JGYJZHYTADCWIK-UHFFFAOYSA-N
Molecular Weight 180.119 g/mol
SMILES N1C(Oc2cc(ccc12)N(=O)=O)=O
SPLASH splash10-0f89-9800000000-84b82d09233866abc37b
Source of Spectrum JX-2012-812
Synonyms 2(3H)-Benzoxazolone, 6-nitro- 2-Benzoxazolinone, 6-nitro- 6-Nitro-1,3-benzoxazol-2(3H)-one 6-Nitro-3H-benzooxazol-2-one 6-Nitro-2-benzoxazolinone 6-Nitro-2-benzoxazolone 6-Nitro-3H-1,3-benzoxazol-2-one 6-Nitrobenzoxazol-2(3H)-one 6-Nitrobenzoxazolin-2-one 6-Nitrobenzoxazolone EINECS 225-157-4
Wiley ID 1661258