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5-Methoxy-2-phenyl-1-benzothiopyran-4-one
SpectraBase Compound ID 7lTfn7AwZuu
InChI InChI=1S/C16H12O2S/c1-18-13-8-5-9-14-16(13)12(17)10-15(19-14)11-6-3-2-4-7-11/h2-10H,1H3
InChIKey ZDXFSBAMCGHZIK-UHFFFAOYSA-N
Mol Weight 268.33 g/mol
Molecular Formula C16H12O2S
Exact Mass 268.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVUDXt8ujoE
Name 5-Methoxy-2-phenyl-1-benzothiopyran-4-one
CAS Registry Number 86406-07-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2S
InChI InChI=1S/C16H12O2S/c1-18-13-8-5-9-14-16(13)12(17)10-15(19-14)11-6-3-2-4-7-11/h2-10H,1H3
InChIKey ZDXFSBAMCGHZIK-UHFFFAOYSA-N
Molecular Weight 268.330 g/mol
SMILES COc1c2c(ccc1)SC(c1ccccc1)=CC2=O
SPLASH splash10-014i-0090000000-70799ef695d8913b076d
Source of Spectrum AJ-56-1251-1
Synonyms 5-Methoxy-2-phenyl-thiochromen-4-one
Wiley ID 1272262