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4-Chlorobutyl 4-(2-bromo-4,5-methylenedioxyphenyl)-3,4-dihydro-6-methyl-2(1H)-oxopyrimidine-5-carboxylate
SpectraBase Compound ID 7mI3XOKht39
InChI InChI=1S/C17H18BrClN2O5/c1-9-14(16(22)24-5-3-2-4-19)15(21-17(23)20-9)10-6-12-13(7-11(10)18)26-8-25-12/h6-7,15H,2-5,8H2,1H3,(H2,20,21,23)
InChIKey CVKINSILOIHDDN-UHFFFAOYSA-N
Mol Weight 445.7 g/mol
Molecular Formula C17H18BrClN2O5
Exact Mass 444.008762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7QA1y46iYKv
Name 4-CHLOROBUTYL 4-(2-BROMO-4,5-METHYLENEDIOXYPHENYL)-3,4-DIHYDRO-6-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H18BrClN2O5
InChI InChI=1S/C17H18BrClN2O5/c1-9-14(16(22)24-5-3-2-4-19)15(21-17(23)20-9)10-6-12-13(7-11(10)18)26-8-25-12/h6-7,15H,2-5,8H2,1H3,(H2,20,21,23)
InChIKey CVKINSILOIHDDN-UHFFFAOYSA-N
Molecular Weight 444.0083
SMILES N1C(=O)NC(c2c(Br)cc3OCOc3c2)C(C(OCCCCCl)=O)=C1C
SPLASH splash10-052f-9311000000-740e19dd1029b1561367
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany