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5-Benzothiazol-2-yl-3,4-dimethyl-5H-furan-2-one
SpectraBase Compound ID GnQcaFalCZe
InChI InChI=1S/C13H11NO2S/c1-7-8(2)13(15)16-11(7)12-14-9-5-3-4-6-10(9)17-12/h3-6,11H,1-2H3
InChIKey TVQIIPMNSMRQCF-UHFFFAOYSA-N
Mol Weight 245.3 g/mol
Molecular Formula C13H11NO2S
Exact Mass 245.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OwRvRGf6Tg
Name 5-Benzothiazol-2-yl-3,4-dimethyl-5H-furan-2-one
Alternate Name(s) 5-(1,3-benzothiazol-2-yl)-3,4-dimethyl-2(5H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO2S
InChI InChI=1S/C13H11NO2S/c1-7-8(2)13(15)16-11(7)12-14-9-5-3-4-6-10(9)17-12/h3-6,11H,1-2H3
InChIKey TVQIIPMNSMRQCF-UHFFFAOYSA-N
Molecular Weight 245.296 g/mol
SMILES C1(OC(C(=C1C)C)c1sc2c(n1)cccc2)=O
SPLASH splash10-0f6t-0290000000-57f327434f8d8f95ee8c
Source of Spectrum O1-63-1042-2
Wiley ID 1592623