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2-(4-Methoxyphenyl)-5-isobutyl-5,6-dihydro-4H,7H-pyrano[2,3-d][1,3]thiazine-4,7-dione
SpectraBase Compound ID 4AalgIaOFA5
InChI InChI=1S/C18H19NO4S/c1-10(2)8-12-9-14(20)23-16-15(12)18(21)24-17(19-16)11-4-6-13(22-3)7-5-11/h4-7,10,12H,8-9H2,1-3H3
InChIKey QAPLYNSSQWGMGG-UHFFFAOYSA-N
Mol Weight 345.41 g/mol
Molecular Formula C18H19NO4S
Exact Mass 345.103479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARvAjJCd7pA
Name 2-(4-Methoxyphenyl)-5-isobutyl-5,6-dihydro-4H,7H-pyrano[2,3-d][1,3]thiazine-4,7-dione
Appearance Pale yellow crystals
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Exact Mass 345.103479266 u
Formula C18H19NO4S
InChI InChI=1S/C18H19NO4S/c1-10(2)8-12-9-14(20)23-16-15(12)18(21)24-17(19-16)11-4-6-13(22-3)7-5-11/h4-7,10,12H,8-9H2,1-3H3
InChIKey QAPLYNSSQWGMGG-UHFFFAOYSA-N
Instrument Name MX-1321
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2226
Molecular Weight 345.413 g/mol
Quality 85
SMILES COC1=CC=C(C=C1)C=1SC(C2=C(N1)OC(CC2CC(C)C)=O)=O
SPLASH splash10-02ar-0698000000-5b9f8e0b0356a560b39e
Source of Spectrum Y-52-1621-5c (DOI: 10.1002/jhet.2226)
Thin-Layer Chromatography 0.52 (acetone/hexane, 1:3)
Wiley ID 1902571