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2-(p-Bromobenzoyl)-5-ethoxycarbonylpyrrolo[2,1-b]thiazole
SpectraBase Compound ID IR4iv6GcKWJ
InChI InChI=1S/C16H12BrNO3S/c1-2-21-16(20)12-7-8-14-18(12)9-13(22-14)15(19)10-3-5-11(17)6-4-10/h3-9H,2H2,1H3
InChIKey OQCCFGZXEFEZFK-UHFFFAOYSA-N
Mol Weight 378.24 g/mol
Molecular Formula C16H12BrNO3S
Exact Mass 376.972127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2UyNEGlRyRZ
Name 2-(p-Bromobenzoyl)-5-ethoxycarbonylpyrrolo[2,1-b]thiazole
Alternate Name(s) Ethyl 2-(4-bromobenzoyl)pyrrolo[2,1-b][1,3]thiazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12BrNO3S
InChI InChI=1S/C16H12BrNO3S/c1-2-21-16(20)12-7-8-14-18(12)9-13(22-14)15(19)10-3-5-11(17)6-4-10/h3-9H,2H2,1H3
InChIKey OQCCFGZXEFEZFK-UHFFFAOYSA-N
Molecular Weight 378.240 g/mol
SMILES c12SC(=C[n]2c(cc1)C(=O)OCC)C(c1ccc(cc1)Br)=O
SPLASH splash10-004i-0109000000-1ffcde0a922f737bac9b
Source of Spectrum F-62-9229-4
Wiley ID 1640805