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2-(4-Methoxyphenyl)-5-ethyl-5,6-dihydro-4H,7H-pyrano[2,3-d][1,3]thiazine-4,7-dione
SpectraBase Compound ID LGNqHFlFkMd
InChI InChI=1S/C16H15NO4S/c1-3-9-8-12(18)21-14-13(9)16(19)22-15(17-14)10-4-6-11(20-2)7-5-10/h4-7,9H,3,8H2,1-2H3
InChIKey SHHJFOLKTKDPSE-UHFFFAOYSA-N
Mol Weight 317.36 g/mol
Molecular Formula C16H15NO4S
Exact Mass 317.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPz6u1aN1Qt
Name 2-(4-Methoxyphenyl)-5-ethyl-5,6-dihydro-4H,7H-pyrano[2,3-d][1,3]thiazine-4,7-dione
Appearance Pale yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO4S
InChI InChI=1S/C16H15NO4S/c1-3-9-8-12(18)21-14-13(9)16(19)22-15(17-14)10-4-6-11(20-2)7-5-10/h4-7,9H,3,8H2,1-2H3
InChIKey SHHJFOLKTKDPSE-UHFFFAOYSA-N
Instrument Name MX-1321
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2226
Molecular Weight 317.359 g/mol
Quality 94
SMILES COC1=CC=C(C=C1)C=1SC(C2=C(N1)OC(CC2CC)=O)=O
SPLASH splash10-001i-0962000000-9fe9c339633f6d428d50
Source of Spectrum Y-52-1620-5a (DOI: 10.1002/jhet.2226)
Thin-Layer Chromatography 0.39 (acetone/hexane, 1:3)
Wiley ID 1902569