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2-(4-Methoxyphenyl)-5-(4-dimethylaminophenyl)-5,6-dihydro-4H,7H-pyrano[2,3-d][1,3]thiazine-4,7-dione
SpectraBase Compound ID ETIBOqdBvvB
InChI InChI=1S/C22H20N2O4S/c1-24(2)15-8-4-13(5-9-15)17-12-18(25)28-20-19(17)22(26)29-21(23-20)14-6-10-16(27-3)11-7-14/h4-11,17H,12H2,1-3H3
InChIKey UUAXBXXDTLNWLX-UHFFFAOYSA-N
Mol Weight 408.47 g/mol
Molecular Formula C22H20N2O4S
Exact Mass 408.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpbihV0YYF4
Name 2-(4-Methoxyphenyl)-5-(4-dimethylaminophenyl)-5,6-dihydro-4H,7H-pyrano[2,3-d][1,3]thiazine-4,7-dione
Appearance Yellow crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N2O4S
InChI InChI=1S/C22H20N2O4S/c1-24(2)15-8-4-13(5-9-15)17-12-18(25)28-20-19(17)22(26)29-21(23-20)14-6-10-16(27-3)11-7-14/h4-11,17H,12H2,1-3H3
InChIKey UUAXBXXDTLNWLX-UHFFFAOYSA-N
Instrument Name MX-1321
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2226
Molecular Weight 408.472 g/mol
Quality 77
SMILES COC1=CC=C(C=C1)C=1SC(C2=C(N1)OC(CC2C1=CC=C(C=C1)N(C)C)=O)=O
SPLASH splash10-001i-0649400000-51a592e4e209d318e051
Source of Spectrum Y-52-1621-5d (DOI: 10.1002/jhet.2226)
Thin-Layer Chromatography 0.81 (methanol/chloroform, 1:9)
Wiley ID 1902572