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3-(4-nitrophenyl)-1,4,2-oxathiazol-5-imine
SpectraBase Compound ID 6Lemhn4HvfC
InChI InChI=1S/C8H5N3O3S/c9-8-14-10-7(15-8)5-1-3-6(4-2-5)11(12)13/h1-4,9H
InChIKey NTNICVMRPAPJHX-UHFFFAOYSA-N
Mol Weight 223.21 g/mol
Molecular Formula C8H5N3O3S
Exact Mass 223.005162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Mgc9sINlcJ
Name 3-(4-nitrophenyl)-1,4,2-oxathiazol-5-imine
CAS Registry Number 86626-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5N3O3S
InChI InChI=1S/C8H5N3O3S/c9-8-14-10-7(15-8)5-1-3-6(4-2-5)11(12)13/h1-4,9H
InChIKey NTNICVMRPAPJHX-UHFFFAOYSA-N
Molecular Weight 223.206 g/mol
SMILES N=C1SC(=NO1)c1ccc(N(=O)=O)cc1
SPLASH splash10-03dj-0910000000-f7a571ab84ad3e71e254
Source of Spectrum Y-20-303-2
Synonyms [3-(4-nitrophenyl)-1,4,2-oxathiazol-5-ylidene]amine
Wiley ID 1223736