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Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4'-mercapto-4,6-dimethoxy-6'-methyl-
SpectraBase Compound ID JW08RLD93Mt
InChI InChI=1S/C16H15ClO5S/c1-7-4-8(23)5-11(18)16(7)15(19)12-9(20-2)6-10(21-3)13(17)14(12)22-16/h5-7,23H,4H2,1-3H3
InChIKey FTDIUIAUWYFBHA-UHFFFAOYSA-N
Mol Weight 354.8 g/mol
Molecular Formula C16H15ClO5S
Exact Mass 354.032872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwWqmaKVndE
Name Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4'-mercapto-4,6-dimethoxy-6'-methyl-
Alternate Name(s) 4,6-Dimethoxy-7-chloro-4'-mercapto-gris-3'-ene-3,2'-dione 7-Chloro-4,6-dimethoxy-6'-methyl-4'-sulfanyl-3H-spiro[1-benzofuran-2,1'-cyclohexan]-3'-ene-2',3-dione
CAS Registry Number 26881-77-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClO5S
InChI InChI=1S/C16H15ClO5S/c1-7-4-8(23)5-11(18)16(7)15(19)12-9(20-2)6-10(21-3)13(17)14(12)22-16/h5-7,23H,4H2,1-3H3
InChIKey FTDIUIAUWYFBHA-UHFFFAOYSA-N
Molecular Weight 354.804 g/mol
SMILES SC=1CC(C2(C(c3c(cc(c(c3O2)Cl)OC)OC)=O)C(C1)=O)C
SPLASH splash10-1000-4498000000-e17e6d7e0dbb928da985
Source of Spectrum O-2-1166-9
Wiley ID 52409