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N-PHENYL-4'-ETHYL-5,6-DIMETHYL-7H-PYRROLO-[2,3-D]-PYRIMIDINE-4-AMINE
SpectraBase Compound ID AH5wqZe7u6R
InChI InChI=1S/C16H18N4/c1-4-12-5-7-13(8-6-12)20-16-14-10(2)11(3)19-15(14)17-9-18-16/h5-9H,4H2,1-3H3,(H2,17,18,19,20)
InChIKey UMKKKGITXSYWJE-UHFFFAOYSA-N
Mol Weight 266.35 g/mol
Molecular Formula C16H18N4
Exact Mass 266.153147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPjCDOeHgaZ
Name (5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-(4-ethylphenyl)amine
Alternate Name(s) N-(4-ethylphenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS Registry Number 100633-84-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N4
InChI InChI=1S/C16H18N4/c1-4-12-5-7-13(8-6-12)20-16-14-10(2)11(3)19-15(14)17-9-18-16/h5-9H,4H2,1-3H3,(H2,17,18,19,20)
InChIKey UMKKKGITXSYWJE-UHFFFAOYSA-N
Molecular Weight 266.348 g/mol
SMILES N1C=NC(=C2C1=NC(=C2C)C)Nc1ccc(cc1)CC
SPLASH splash10-014i-0090000000-84eaf8da8a61d555489e
Source of Spectrum Y-22-862-7
Wiley ID 1270312