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5-tert-Butyl-7-chloranyl-1,2,3-benzodithiazol-6-one
SpectraBase Compound ID 6626hM17r25
InChI InChI=1S/C10H10ClNOS2/c1-10(2,3)5-4-6-9(14-15-12-6)7(11)8(5)13/h4H,1-3H3
InChIKey MDBGAFGNEHMDNJ-UHFFFAOYSA-N
Mol Weight 259.77 g/mol
Molecular Formula C10H10ClNOS2
Exact Mass 258.989234 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjcooCLIg7t
Name 5-tert-Butyl-7-chloranyl-1,2,3-benzodithiazol-6-one
Alternate Name(s) 5-tert-Butyl-7-chloro-1,2,3-benzodithiazol-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10ClNOS2
InChI InChI=1S/C10H10ClNOS2/c1-10(2,3)5-4-6-9(14-15-12-6)7(11)8(5)13/h4H,1-3H3
InChIKey MDBGAFGNEHMDNJ-UHFFFAOYSA-N
Molecular Weight 259.769 g/mol
SMILES C12=C(C(=O)C(=CC2=NSS1)C(C)(C)C)Cl
SPLASH splash10-0007-0090000000-cee772f160521dae4f35
Source of Spectrum PS-54-229-9
Wiley ID 805154