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5-Hydroxy-4-[(4'-methoxyphenyl)thio]-6-(2'-propenyl)-1,3-benzodioxole
SpectraBase Compound ID Cv59iIBekFV
InChI InChI=1S/C17H16O4S/c1-3-4-11-9-14-16(21-10-20-14)17(15(11)18)22-13-7-5-12(19-2)6-8-13/h3,5-9,18H,1,4,10H2,2H3
InChIKey ZPFFWEBPZONEBO-UHFFFAOYSA-N
Mol Weight 316.37 g/mol
Molecular Formula C17H16O4S
Exact Mass 316.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILy0l4fXuyw
Name 5-Hydroxy-4-[(4'-methoxyphenyl)thio]-6-(2'-propenyl)-1,3-benzodioxole
Alternate Name(s) 6-Allyl-4-[(4-methoxyphenyl)sulfanyl]-1,3-benzodioxol-5-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O4S
InChI InChI=1S/C17H16O4S/c1-3-4-11-9-14-16(21-10-20-14)17(15(11)18)22-13-7-5-12(19-2)6-8-13/h3,5-9,18H,1,4,10H2,2H3
InChIKey ZPFFWEBPZONEBO-UHFFFAOYSA-N
Molecular Weight 316.371 g/mol
SMILES Oc1c(c2c(OCO2)cc1CC=C)Sc1ccc(cc1)OC
SPLASH splash10-014i-0319000000-281a36aadc4887fd4d6c
Source of Spectrum I-78-1353-22
Wiley ID 812830