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Ethyl 2-(5-Benzoyl-3-nitro-2-thienylthio)acetate
SpectraBase Compound ID 1bjko1a4Buv
InChI InChI=1S/C15H13NO5S2/c1-2-21-13(17)9-22-15-11(16(19)20)8-12(23-15)14(18)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3
InChIKey HQEPMOLLXGMQBO-UHFFFAOYSA-N
Mol Weight 351.39 g/mol
Molecular Formula C15H13NO5S2
Exact Mass 351.023515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PswRDon6Oz
Name Ethyl 2-(5-Benzoyl-3-nitro-2-thienylthio)acetate
Alternate Name(s) Ethyl 2-((5-benzoyl-3-nitrothiophen-2-yl)thio)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NO5S2
InChI InChI=1S/C15H13NO5S2/c1-2-21-13(17)9-22-15-11(16(19)20)8-12(23-15)14(18)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3
InChIKey HQEPMOLLXGMQBO-UHFFFAOYSA-N
Literature Reference DOI 10.1002_(SICI)1521-4184(200002)333_2_3_58
Molecular Weight 351.391 g/mol
SMILES C(CSc1c(cc(s1)C(c1ccccc1)=O)[N+](=O)[O-])(=O)OCC
SPLASH splash10-0a6r-7902000000-f70dc44173f92b74ed0c
Source of Spectrum APP-333-60-4
Wiley ID 1770376