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2H-1,4-thiazine-3,6-dicarboxylic acid, 3,4-dihydro-5-methyl-, 6-ethyl ester
SpectraBase Compound ID KsmT5UlsKgl
InChI InChI=1S/C9H13NO4S/c1-3-14-9(13)7-5(2)10-6(4-15-7)8(11)12/h6,10H,3-4H2,1-2H3,(H,11,12)
InChIKey QFESWKOGHBKEEJ-UHFFFAOYSA-N
Mol Weight 231.27 g/mol
Molecular Formula C9H13NO4S
Exact Mass 231.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9caJ83OJJg5
Name 2H-1,4-thiazine-3,6-dicarboxylic acid, 3,4-dihydro-5-methyl-, 6-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4S
InChI InChI=1S/C9H13NO4S/c1-3-14-9(13)7-5(2)10-6(4-15-7)8(11)12/h6,10H,3-4H2,1-2H3,(H,11,12)
InChIKey QFESWKOGHBKEEJ-UHFFFAOYSA-N
Molecular Weight 231.266 g/mol
SMILES N1C(C(=O)O)CSC(=C1C)C(=O)OCC
SPLASH splash10-03dl-9510000000-b0b8ef0cc5957a7d1c1c
Synonyms 6-(ethoxycarbonyl)-5-methyl-3,4-dihydro-2H-1,4-thiazine-3-carboxylic acid
Wiley ID 1512130