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Ethyl 6-(benzo[d][1,3]dioxol-5-yl)-2-(ethylthio)-4-methyl-1,6-dihydropyrimidine-5-carboxylate
SpectraBase Compound ID B777Y3Q6mCh
InChI InChI=1S/C17H20N2O4S/c1-4-21-16(20)14-10(3)18-17(24-5-2)19-15(14)11-6-7-12-13(8-11)23-9-22-12/h6-8,15H,4-5,9H2,1-3H3,(H,18,19)
InChIKey RBZXFDQWPQVEES-UHFFFAOYSA-N
Mol Weight 348.42 g/mol
Molecular Formula C17H20N2O4S
Exact Mass 348.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jhX4ICMSBU
Name Ethyl 6-(benzo[d][1,3]dioxol-5-yl)-2-(ethylthio)-4-methyl-1,6-dihydropyrimidine-5-carboxylate
Appearance Brown crystals
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Formula C17H20N2O4S
InChI InChI=1S/C17H20N2O4S/c1-4-21-16(20)14-10(3)18-17(24-5-2)19-15(14)11-6-7-12-13(8-11)23-9-22-12/h6-8,15H,4-5,9H2,1-3H3,(H,18,19)
InChIKey RBZXFDQWPQVEES-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP-1000EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2358
Molecular Weight 348.417 g/mol
SMILES N1C(C(=C(N=C1SCC)C)C(OCC)=O)c1ccc2c(OCO2)c1
SPLASH splash10-0r9r-9111000000-ae275be5cd09a56e36bd
Source of Spectrum Y-53-551-3a
Wiley ID 1877647