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2-[(2-Chloro-6-nitrobenzyl)sulfanyl]-6-ethoxy-1,3-benzothiazole
SpectraBase Compound ID Azd3mnfw351
InChI InChI=1S/C16H13ClN2O3S2/c1-2-22-10-6-7-13-15(8-10)24-16(18-13)23-9-11-12(17)4-3-5-14(11)19(20)21/h3-8H,2,9H2,1H3
InChIKey DCHYKGSTLTZXEC-UHFFFAOYSA-N
Mol Weight 380.86 g/mol
Molecular Formula C16H13ClN2O3S2
Exact Mass 380.005612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoAryqG9Rnt
Name 2-[(2-Chloro-6-nitrobenzyl)sulfanyl]-6-ethoxy-1,3-benzothiazole
Alternate Name(s) 2-(2-Chloro-6-nitro-benzylsulfanyl)-6-ethoxy-benzothiazole 2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-6-ethoxy-1,3-benzothiazole 2-[(2-chloro-6-nitro-benzyl)thio]-6-ethoxy-1,3-benzothiazole 2-[(2-chloro-6-nitro-phenyl)methylsulfanyl]-6-ethoxy-1,3-benzothiazole 2-[(2-chloro-6-nitrophenyl)methylthio]-6-ethoxy-1,3-benzothiazole
CAS Registry Number 346639-45-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClN2O3S2
InChI InChI=1S/C16H13ClN2O3S2/c1-2-22-10-6-7-13-15(8-10)24-16(18-13)23-9-11-12(17)4-3-5-14(11)19(20)21/h3-8H,2,9H2,1H3
InChIKey DCHYKGSTLTZXEC-UHFFFAOYSA-N
Molecular Weight 380.864 g/mol
SMILES CCOc1cc2sc(SCc3c(N(=O)=O)cccc3Cl)nc2cc1
SPLASH splash10-01q9-3942000000-25759673fc8f2aff1339
Wiley ID 1461151