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Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4,6-dimethoxy-6'-methyl-4'-(methylthio)-
SpectraBase Compound ID G4rtymiqj6s
InChI InChI=1S/C17H17ClO5S/c1-8-5-9(24-4)6-12(19)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)23-17/h6-8H,5H2,1-4H3
InChIKey KXOZDHIFNBTGKC-UHFFFAOYSA-N
Mol Weight 368.83 g/mol
Molecular Formula C17H17ClO5S
Exact Mass 368.048523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5u3kBXCMcSv
Name Spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione, 7-chloro-4,6-dimethoxy-6'-methyl-4'-(methylthio)-
CAS Registry Number 26881-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClO5S
InChI InChI=1S/C17H17ClO5S/c1-8-5-9(24-4)6-12(19)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)23-17/h6-8H,5H2,1-4H3
InChIKey KXOZDHIFNBTGKC-UHFFFAOYSA-N
Molecular Weight 368.831 g/mol
SMILES CC1CC(=CC(C11C(c2c(cc(c(c2O1)Cl)OC)OC)=O)=O)SC
SPLASH splash10-0gb9-5396000000-5f234512c013ac58c037
Source of Spectrum O-2-1166-8
Synonyms 7-Chloranyl-4,6-dimethoxy-5'-methyl-3'-methylsulfanyl-spiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione 7-Chloro-4,6-dimethoxy-5'-methyl-3'-(methylthio)spiro[benzofuran-2,6'-cyclohex-2-ene]-1',3-dione 7-Chloro-4,6-dimethoxy-5'-methyl-3'-(methylthio)spiro[coumaran-2,6'-cyclohex-2-ene]-1',3-quinone 7-Chloro-4,6-dimethoxy-5'-methyl-3'-methylsulfanyl-spiro[benzofuran-2,6'-cyclohex-2-ene]-1',3-dione 7-Chloro-4,6-dimethoxy-5'-methyl-3'-methylsulfanylspiro[1-benzofuran-2,6'-cyclohex-2-ene]-1',3-dione
Wiley ID 54039