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1,3-Dibenzyl-5-(4-carboethoxyphenyl)uracil
SpectraBase Compound ID 5zxU2O7Loxa
InChI InChI=1S/C27H24N2O4/c1-2-33-26(31)23-15-13-22(14-16-23)24-19-28(17-20-9-5-3-6-10-20)27(32)29(25(24)30)18-21-11-7-4-8-12-21/h3-16,19H,2,17-18H2,1H3
InChIKey ZXPZZHUJLXPTDK-UHFFFAOYSA-N
Mol Weight 440.5 g/mol
Molecular Formula C27H24N2O4
Exact Mass 440.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuiS54jhKn6
Name 1,3-Dibenzyl-5-(4-carboethoxyphenyl)uracil
Alternate Name(s) ethyl 4-(1,3-dibenzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)benzoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N2O4
InChI InChI=1S/C27H24N2O4/c1-2-33-26(31)23-15-13-22(14-16-23)24-19-28(17-20-9-5-3-6-10-20)27(32)29(25(24)30)18-21-11-7-4-8-12-21/h3-16,19H,2,17-18H2,1H3
InChIKey ZXPZZHUJLXPTDK-UHFFFAOYSA-N
Molecular Weight 440.499 g/mol
SMILES C1(N(C(C(=CN1Cc1ccccc1)c1ccc(C(=O)OCC)cc1)=O)Cc1ccccc1)=O
SPLASH splash10-0006-9000600000-47f324515877df801ffb
Source of Spectrum F-53-7252-20
Wiley ID 802203