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4-(2-Aza-5-thiacyclopentylidene)-3-phenylisoxazol-5(4H)-one
SpectraBase Compound ID CcyjokLqvfe
InChI InChI=1S/C12H10N2O2S/c15-12-9(11-13-6-7-17-11)10(14-16-12)8-4-2-1-3-5-8/h1-5,13H,6-7H2/b11-9-
InChIKey SYJSEJAJGULEGX-LUAWRHEFSA-N
Mol Weight 246.28 g/mol
Molecular Formula C12H10N2O2S
Exact Mass 246.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67x4p2ptYGW
Name 4-(2-Aza-5-thiacyclopentylidene)-3-phenylisoxazol-5(4H)-one
Alternate Name(s) (4Z)-3-phenyl-4-(1,3-thiazolidin-2-ylidene)-5(4H)-isoxazolone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2O2S
InChI InChI=1S/C12H10N2O2S/c15-12-9(11-13-6-7-17-11)10(14-16-12)8-4-2-1-3-5-8/h1-5,13H,6-7H2/b11-9-
InChIKey SYJSEJAJGULEGX-LUAWRHEFSA-N
Molecular Weight 246.284 g/mol
SMILES N1CCS\C1=C/1C(=NOC1=O)c1ccccc1
SPLASH splash10-0f97-7960000000-da50322302eff4d5542d
Source of Spectrum C-116-2012-6
Wiley ID 1248617