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1-Methoxy-9-mercaptophenoxathiin 10,10-dioxide

View entire compound with spectra: 1 MS (GC)

1-Methoxy-9-mercaptophenoxathiin 10,10-dioxide
SpectraBase Compound ID 1AkPxw5eRqR
InChI InChI=1S/C13H10O4S2/c1-16-8-4-2-5-9-12(8)19(14,15)13-10(17-9)6-3-7-11(13)18/h2-7,18H,1H3
InChIKey IFADWHDEAWRMGN-UHFFFAOYSA-N
Mol Weight 294.34 g/mol
Molecular Formula C13H10O4S2
Exact Mass 294.002051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9NI3iG2euHe
Name 1-Methoxy-9-mercaptophenoxathiin 10,10-dioxide
Alternate Name(s) 9-Methoxy-1-phenoxathiinthiol 10,10-dioxide 9-Methoxy-10,10-dioxido-1-phenoxathiinyl hydrosulfide
CAS Registry Number 120546-92-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O4S2
InChI InChI=1S/C13H10O4S2/c1-16-8-4-2-5-9-12(8)19(14,15)13-10(17-9)6-3-7-11(13)18/h2-7,18H,1H3
InChIKey IFADWHDEAWRMGN-UHFFFAOYSA-N
Molecular Weight 294.339 g/mol
SMILES Sc1c2S(c3c(Oc2ccc1)cccc3OC)(=O)=O
SPLASH splash10-0006-0090000000-699ac746980ecc1563fb
Source of Spectrum J-54-3650-4
Wiley ID 1296797