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(1E)-1-(3-phenyl-1,4,2-oxathiazol-5-ylidene)urea
SpectraBase Compound ID 1bDLQFmNGzO
InChI InChI=1S/C9H7N3O2S/c10-8(13)11-9-14-12-7(15-9)6-4-2-1-3-5-6/h1-5H,(H2,10,13)/b11-9+
InChIKey GSQBHDNSXWVZHL-PKNBQFBNSA-N
Mol Weight 221.23 g/mol
Molecular Formula C9H7N3O2S
Exact Mass 221.025898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYURGTvddqc
Name (1E)-1-(3-phenyl-1,4,2-oxathiazol-5-ylidene)urea
CAS Registry Number 86626-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N3O2S
InChI InChI=1S/C9H7N3O2S/c10-8(13)11-9-14-12-7(15-9)6-4-2-1-3-5-6/h1-5H,(H2,10,13)/b11-9+
InChIKey GSQBHDNSXWVZHL-PKNBQFBNSA-N
Molecular Weight 221.234 g/mol
SMILES NC(\N=C\1SC(=NO1)c1ccccc1)=O
SPLASH splash10-014i-0910000000-84cc675db90f24d6e3fd
Source of Spectrum Y-20-303-2
Synonyms (E)-(3-phenyl-1,4,2-oxathiazol-5-ylidene)urea
Wiley ID 1221039