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(E)-2-(4-(4-bromostyryl)phenoxy)-N-(1-methyl-2-oxo-1,2-dihydropyrimidin-4-yl)propanamide
SpectraBase Compound ID Lr8hVBgrcSN
InChI InChI=1S/C22H20BrN3O3/c1-15(21(27)24-20-13-14-26(2)22(28)25-20)29-19-11-7-17(8-12-19)4-3-16-5-9-18(23)10-6-16/h3-15H,1-2H3,(H,24,25,27,28)/b4-3+
InChIKey SOEINVHJDAVRRY-ONEGZZNKSA-N
Mol Weight 454.32 g/mol
Molecular Formula C22H20BrN3O3
Exact Mass 453.068805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJxkQD9tKcZ
Name (E)-2-(4-(4-bromostyryl)phenoxy)-N-(1-methyl-2-oxo-1,2-dihydropyrimidin-4-yl)propanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20BrN3O3
InChI InChI=1S/C22H20BrN3O3/c1-15(21(27)24-20-13-14-26(2)22(28)25-20)29-19-11-7-17(8-12-19)4-3-16-5-9-18(23)10-6-16/h3-15H,1-2H3,(H,24,25,27,28)/b4-3+
InChIKey SOEINVHJDAVRRY-ONEGZZNKSA-N
Literature Reference DOI 10.1002/rcm.2318
Molecular Weight 454.324 g/mol
SMILES N(C(C(Oc1ccc(\C=C\c2ccc(cc2)Br)cc1)C)=O)C1=NC(N(C=C1)C)=O
SPLASH splash10-0f89-0900000000-782b2f89cf8044326471
Source of Spectrum RCM-20-519-14
Wiley ID 1820476