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3-(2',4',6'-Trimethylphenyl)-4-[2"-(tetrahydropyrimidinyl)]-5-phenylisoxazole
SpectraBase Compound ID APhVb8Ym9Pq
InChI InChI=1S/C22H23N3O/c1-14-12-15(2)18(16(3)13-14)20-19(22-23-10-7-11-24-22)21(26-25-20)17-8-5-4-6-9-17/h4-6,8-9,12-13H,7,10-11H2,1-3H3,(H,23,24)
InChIKey MYDMAPFWPCPORU-UHFFFAOYSA-N
Mol Weight 345.45 g/mol
Molecular Formula C22H23N3O
Exact Mass 345.184112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kQWhrpt3bI
Name 3-(2',4',6'-Trimethylphenyl)-4-[2"-(tetrahydropyrimidinyl)]-5-phenylisoxazole
Alternate Name(s) 2-(3-mesityl-5-phenyl-4-isoxazolyl)-1,4,5,6-tetrahydropyrimidine 3-(2',4',6'-Trimethylphenyl)-4-[2''-(tetrahydropyrimidinyl)]-5-phenylisoxazole
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Formula C22H23N3O
InChI InChI=1S/C22H23N3O/c1-14-12-15(2)18(16(3)13-14)20-19(22-23-10-7-11-24-22)21(26-25-20)17-8-5-4-6-9-17/h4-6,8-9,12-13H,7,10-11H2,1-3H3,(H,23,24)
InChIKey MYDMAPFWPCPORU-UHFFFAOYSA-N
Molecular Weight 345.446 g/mol
SMILES N1CCCN=C1c1c(noc1-c1ccccc1)-c1c(cc(cc1C)C)C
SPLASH splash10-0059-5009000000-51f18e94d75f93a53358
Source of Spectrum SK-21-1914-5
Wiley ID 851923