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3-Chloro-5-(fur-2-yl)-4H-1,2,6-thiadiazin-4-one
SpectraBase Compound ID 9j3Ozkq6bbK
InChI InChI=1S/C7H3ClN2O2S/c8-7-6(11)5(9-13-10-7)4-2-1-3-12-4/h1-3H
InChIKey KPRRQIYJFXCUFC-UHFFFAOYSA-N
Mol Weight 214.63 g/mol
Molecular Formula C7H3ClN2O2S
Exact Mass 213.960376 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID UsCwl2UOO
Name 3-Chloro-5-(fur-2-yl)-4H-1,2,6-thiadiazin-4-one
Alternate Name(s) 3-Chloro-5-(furan-2-yl)-4H-1,2,6-thiadiazin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3ClN2O2S
InChI InChI=1S/C7H3ClN2O2S/c8-7-6(11)5(9-13-10-7)4-2-1-3-12-4/h1-3H
InChIKey KPRRQIYJFXCUFC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol2025235
Molecular Weight 214.626 g/mol
SMILES C1(=NSN=C(C1=O)c1occc1)Cl
SPLASH splash10-01vo-9570000000-7922432ac0ed5eaee39d
Source of Spectrum A1-13-5886/SMS8-11b
Wiley ID 1753894