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3-Methylcyclohexyl 4-(2-bromo-4,5-methylenedioxyphenyl)-3,4-dihydro-6-methyl-2(1H)-oxo-5-pyrimidinecarboxylate
SpectraBase Compound ID UNasci6kDo
InChI InChI=1S/C20H23BrN2O5/c1-10-4-3-5-12(6-10)28-19(24)17-11(2)22-20(25)23-18(17)13-7-15-16(8-14(13)21)27-9-26-15/h7-8,10,12,18H,3-6,9H2,1-2H3,(H2,22,23,25)
InChIKey UXTDAXHFIINMMW-UHFFFAOYSA-N
Mol Weight 451.32 g/mol
Molecular Formula C20H23BrN2O5
Exact Mass 450.079035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCtfmw5ddej
Name 3-METHYLCYCLOHEXYL 4-(2-BROMO-4,5-METHYLENEDIOXYPHENYL)-3,4-DIHYDRO-6-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H23BrN2O5
InChI InChI=1S/C20H23BrN2O5/c1-10-4-3-5-12(6-10)28-19(24)17-11(2)22-20(25)23-18(17)13-7-15-16(8-14(13)21)27-9-26-15/h7-8,10,12,18H,3-6,9H2,1-2H3,(H2,22,23,25)
InChIKey UXTDAXHFIINMMW-UHFFFAOYSA-N
Molecular Weight 450.0784
SMILES N1C(=O)NC(c2c(Br)cc3OCOc3c2)C(C(OC2CCCC(C)C2)=O)=C1C
SPLASH splash10-0a4l-9330000000-566e502e6fbf72d95db6
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany