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2-Oxo-1,3-benzoxathiol-5-yl acetate
SpectraBase Compound ID 7YC6gH5q2VR
InChI InChI=1S/C9H6O4S/c1-5(10)12-6-2-3-7-8(4-6)14-9(11)13-7/h2-4H,1H3
InChIKey GBLGMSCMLNOGSY-UHFFFAOYSA-N
Mol Weight 210.2 g/mol
Molecular Formula C9H6O4S
Exact Mass 209.99868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XwQWgfYYvT
Name 2-Oxo-1,3-benzoxathiol-5-yl acetate
Alternate Name(s) (2-oxidanylidene-1,3-benzoxathiol-5-yl) ethanoate Acetic acid (2-keto-1,3-benzoxathiol-5-yl) ester Acetic acid (2-oxo-1,3-benzoxathiol-5-yl) ester Acetic acid, (2-oxo-benzoxathiol-5-yl) ester
CAS Registry Number 82531-06-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6O4S
InChI InChI=1S/C9H6O4S/c1-5(10)12-6-2-3-7-8(4-6)14-9(11)13-7/h2-4H,1H3
InChIKey GBLGMSCMLNOGSY-UHFFFAOYSA-N
Molecular Weight 210.203 g/mol
SMILES C1(Sc2cc(OC(=O)C)ccc2O1)=O
SPLASH splash10-0006-9300000000-52460976dc0c1067fcfc
Source of Spectrum AD-0-2532-0
Wiley ID 1423778