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5-Pyrimidinecarbonitrile, 2-ethoxy-4-phenyl-

View entire compound with spectra: 1 MS (GC)

5-Pyrimidinecarbonitrile, 2-ethoxy-4-phenyl-
SpectraBase Compound ID AmTnaJYOw07
InChI InChI=1S/C13H11N3O/c1-2-17-13-15-9-11(8-14)12(16-13)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3
InChIKey LXGQMVREMLUHIB-UHFFFAOYSA-N
Mol Weight 225.25 g/mol
Molecular Formula C13H11N3O
Exact Mass 225.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ET3ItE6njPO
Name 5-Pyrimidinecarbonitrile, 2-ethoxy-4-phenyl-
Alternate Name(s) 2-Ethoxy-4-phenyl-5-pyrimidinecarbonitrile 2-Ethoxy-4-phenylpyrimidine-5-carbonitrile
CAS Registry Number 89079-67-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3O
InChI InChI=1S/C13H11N3O/c1-2-17-13-15-9-11(8-14)12(16-13)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3
InChIKey LXGQMVREMLUHIB-UHFFFAOYSA-N
Molecular Weight 225.251 g/mol
SMILES c1(nc(ncc1C#N)OCC)-c1ccccc1
SPLASH splash10-001j-0930000000-40a0235d4e5fe0171bdf
Source of Spectrum SB-37-615-0
Wiley ID 1226438