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6-Ethoxycarbonyl-7-methyl-5-(3'-nitrophenyl)-5,8-dihydro-2H-pyrido[3,2-e][1,3]thiazin-2-iminium chloride
SpectraBase Compound ID 9hAK7pUjqvF
InChI InChI=1S/C17H16N4O4S.ClH/c1-3-25-16(22)13-9(2)20-15-12(8-19-17(18)26-15)14(13)10-5-4-6-11(7-10)21(23)24;/h4-8,14,18,20H,3H2,1-2H3;1H
InChIKey YMUIWEHONQTKBU-UHFFFAOYSA-N
Mol Weight 408.86 g/mol
Molecular Formula C17H17ClN4O4S
Exact Mass 408.065904 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDeB1xYt0rC
Name 6-Ethoxycarbonyl-7-methyl-5-(3'-nitrophenyl)-5,8-dihydro-2H-pyrido[3,2-e][1,3]thiazin-2-iminium chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN4O4S
InChI InChI=1S/C17H16N4O4S.ClH/c1-3-25-16(22)13-9(2)20-15-12(8-19-17(18)26-15)14(13)10-5-4-6-11(7-10)21(23)24;/h4-8,14,18,20H,3H2,1-2H3;1H
InChIKey YMUIWEHONQTKBU-UHFFFAOYSA-N
Molecular Weight 408.860 g/mol
SMILES [Cl-].N1C=2SC(N=CC2C(c2cc(N(=O)=O)ccc2)C(=C1C)C(=O)OCC)=[NH2+]
SPLASH splash10-0uk9-0192000000-53f4dc42784fa76690ff
Source of Spectrum F-62-1369-8
Synonyms 6-(ethoxycarbonyl)-7-methyl-5-(3-nitrophenyl)-5,8-dihydro-2H-pyrido[3,2-e][1,3]thiazin-2-iminium chloride
Wiley ID 1632169