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5-(benzo[b]thiophen-2-ylmethyl)benzo[d][1,3]dioxole
SpectraBase Compound ID 6alZbs4m4Hr
InChI InChI=1S/C16H12O2S/c1-2-4-16-12(3-1)9-13(19-16)7-11-5-6-14-15(8-11)18-10-17-14/h1-6,8-9H,7,10H2
InChIKey FROHULSPCZZXFN-UHFFFAOYSA-N
Mol Weight 268.33 g/mol
Molecular Formula C16H12O2S
Exact Mass 268.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AS72KipywPg
Name 5-(benzo[b]thiophen-2-ylmethyl)benzo[d][1,3]dioxole
Alternate Name(s) 5-(1-benzothiophen-2-ylmethyl)-1,3-benzodioxole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2S
InChI InChI=1S/C16H12O2S/c1-2-4-16-12(3-1)9-13(19-16)7-11-5-6-14-15(8-11)18-10-17-14/h1-6,8-9H,7,10H2
InChIKey FROHULSPCZZXFN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol300517q
Molecular Weight 268.330 g/mol
SMILES c1cc2cc(Cc3cc4c(cc3)OCO4)sc2cc1
SPLASH splash10-014i-0290000000-3546abe8342db4886229
Source of Spectrum A1-14-1951/SM14-10h
Wiley ID 1750207