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1,4-Naphthalenedione, 2-chloro-3-(5-iodo-2-thienyl)-
SpectraBase Compound ID 11c68w2Ii3X
InChI InChI=1S/C14H6ClIO2S/c15-12-11(9-5-6-10(16)19-9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6H
InChIKey YEEFPIZYVBUFBL-UHFFFAOYSA-N
Mol Weight 400.62 g/mol
Molecular Formula C14H6ClIO2S
Exact Mass 399.882173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCRCl44wKL5
Name 1,4-Naphthalenedione, 2-chloro-3-(5-iodo-2-thienyl)-
Alternate Name(s) 2-Chloro-3-(5-iodo-2-thienyl)-1,4-naphthoquinone 2-Chloro-3-(5-iodo-2-thiophenyl)naphthalene-1,4-dione 2-Chloro-3-(5-iodothiophen-2-yl)naphthalene-1,4-dione 2-Chloro-3-(5-iodo-2-thienyl)naphthalene-1,4-dione
CAS Registry Number 112616-34-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H6ClIO2S
InChI InChI=1S/C14H6ClIO2S/c15-12-11(9-5-6-10(16)19-9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6H
InChIKey YEEFPIZYVBUFBL-UHFFFAOYSA-N
Molecular Weight 400.617 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)Cl)c1sc(I)cc1
SPLASH splash10-0udi-0013900000-4e4abb72719ee2e6cf41
Source of Spectrum AJ-60-1849-3
Wiley ID 1369186