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6-Benzothiazol-2-yl-5-methyl-3,6-dihydropyran-2-one
SpectraBase Compound ID AKNYdP9rAiv
InChI InChI=1S/C13H11NO2S/c1-8-6-7-11(15)16-12(8)13-14-9-4-2-3-5-10(9)17-13/h2-6,12H,7H2,1H3
InChIKey JNRDFAWLKUZQOM-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 TAWJ47d9Wn
Name 6-Benzothiazol-2-yl-5-methyl-3,6-dihydropyran-2-one
Alternate Name(s) 6-(1,3-benzothiazol-2-yl)-5-methyl-3,6-dihydro-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO2S
InChI InChI=1S/C13H11NO2S/c1-8-6-7-11(15)16-12(8)13-14-9-4-2-3-5-10(9)17-13/h2-6,12H,7H2,1H3
InChIKey JNRDFAWLKUZQOM-UHFFFAOYSA-N
Molecular Weight 245.296 g/mol
SMILES C1(CC=C(C(O1)c1sc2c(n1)cccc2)C)=O
SPLASH splash10-0udi-0090000000-17b2f15369cb4c91e984
Source of Spectrum O1-63-1042-3
Wiley ID 1592622