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Ethyl 5-(benzo[d][1,3]dioxol-5-yl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID JWPxCXbfj7s
InChI InChI=1S/C17H16N2O5S/c1-3-22-16(21)14-9(2)18-17-19(13(20)7-25-17)15(14)10-4-5-11-12(6-10)24-8-23-11/h4-6,15H,3,7-8H2,1-2H3
InChIKey MASAWHHQNXHKRT-UHFFFAOYSA-N
Mol Weight 360.38 g/mol
Molecular Formula C17H16N2O5S
Exact Mass 360.077993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwT2chRfUqq
Name Ethyl 5-(benzo[d][1,3]dioxol-5-yl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
Appearance Brown crystals
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Formula C17H16N2O5S
InChI InChI=1S/C17H16N2O5S/c1-3-22-16(21)14-9(2)18-17-19(13(20)7-25-17)15(14)10-4-5-11-12(6-10)24-8-23-11/h4-6,15H,3,7-8H2,1-2H3
InChIKey MASAWHHQNXHKRT-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2358
Molecular Weight 360.384 g/mol
SMILES C(C)OC(=O)C1=C(N=C2N(C1c1ccc3c(OCO3)c1)C(CS2)=O)C
SPLASH splash10-01p9-1091000000-f2f96e06ffafed94dd0c
Source of Spectrum Y-53-552-7a
Wiley ID 1877651