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2-(3-Hydroxy-4-methoxyphenyl)-1,3-benzoxathiole
SpectraBase Compound ID DggZnfaJ79E
InChI InChI=1S/C14H12O3S/c1-16-11-7-6-9(8-10(11)15)14-17-12-4-2-3-5-13(12)18-14/h2-8,14-15H,1H3
InChIKey KFPQPMPKHPKBDG-UHFFFAOYSA-N
Mol Weight 260.31 g/mol
Molecular Formula C14H12O3S
Exact Mass 260.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ac8jfK3AuQ
Name 2-(3-Hydroxy-4-methoxyphenyl)-1,3-benzoxathiole
Alternate Name(s) 5-(1,3-benzoxathiol-2-yl)-2-methoxyphenol
Comments Less than 3 mono-isotopic peaks
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Formula C14H12O3S
InChI InChI=1S/C14H12O3S/c1-16-11-7-6-9(8-10(11)15)14-17-12-4-2-3-5-13(12)18-14/h2-8,14-15H,1H3
InChIKey KFPQPMPKHPKBDG-UHFFFAOYSA-N
Molecular Weight 260.307 g/mol
SMILES Oc1cc(C2Oc3c(S2)cccc3)ccc1OC
SPLASH splash10-03di-0290000000-94840aef70a39b4f5406
Source of Spectrum KC-1993-1363-10
Wiley ID 778072