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N-[(4-Amino-2-methoxy-1-methyl-6-oxo-1,6-dihydropyrimidin-5-yl)methyl]-2-chloro-N,2-diphenylacetamide
SpectraBase Compound ID IwQqusNOyG5
InChI InChI=1S/C21H21ClN4O3/c1-25-19(27)16(18(23)24-21(25)29-2)13-26(15-11-7-4-8-12-15)20(28)17(22)14-9-5-3-6-10-14/h3-12,17H,13,23H2,1-2H3
InChIKey KVXAOUFSSMMZRM-UHFFFAOYSA-N
Mol Weight 412.88 g/mol
Molecular Formula C21H21ClN4O3
Exact Mass 412.130218 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J0l5b10NHK9
Name N-[(4-Amino-2-methoxy-1-methyl-6-oxo-1,6-dihydropyrimidin-5-yl)methyl]-2-chloro-N,2-diphenylacetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21ClN4O3
InChI InChI=1S/C21H21ClN4O3/c1-25-19(27)16(18(23)24-21(25)29-2)13-26(15-11-7-4-8-12-15)20(28)17(22)14-9-5-3-6-10-14/h3-12,17H,13,23H2,1-2H3
InChIKey KVXAOUFSSMMZRM-UHFFFAOYSA-N
Instrument Name SHIMADZU 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2016.07.012
Molecular Weight 412.877 g/mol
Reported Formula C21H21N4O3Cl
SMILES NC=1N=C(N(C(C1CN(C(C(c1ccccc1)Cl)=O)c1ccccc1)=O)C)OC
SPLASH splash10-014i-0920000000-689fd432c476c6820e07
Source of Spectrum AJC-12-SM101-5c
Wiley ID 1857370