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2-Amino-8-methyl-6-(4-methoxyphenyl)-4-[2H-4-hydroxy-2-oxo[1]benzopyran-3-yl]pyrimidine
SpectraBase Compound ID 9K1r1dzYICQ
InChI InChI=1S/C21H17N3O4/c1-11-4-3-5-14-18(25)17(20(26)28-19(11)14)16-10-15(23-21(22)24-16)12-6-8-13(27-2)9-7-12/h3-10,25H,1-2H3,(H2,22,23,24)
InChIKey OSKPJWDSCMKIRW-UHFFFAOYSA-N
Mol Weight 375.38 g/mol
Molecular Formula C21H17N3O4
Exact Mass 375.121906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMybKLXkvVY
Name 2-Amino-8-methyl-6-(4-methoxyphenyl)-4-[2H-4-hydroxy-2-oxo[1]benzopyran-3-yl]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17N3O4
InChI InChI=1S/C21H17N3O4/c1-11-4-3-5-14-18(25)17(20(26)28-19(11)14)16-10-15(23-21(22)24-16)12-6-8-13(27-2)9-7-12/h3-10,25H,1-2H3,(H2,22,23,24)
InChIKey OSKPJWDSCMKIRW-UHFFFAOYSA-N
Molecular Weight 375.384 g/mol
SMILES OC1=C(c2nc(nc(c2)-c2ccc(cc2)OC)N)C(Oc2c(cccc12)C)=O
SPLASH splash10-004i-8912000000-8c99ae629fedd7126256
Source of Spectrum Y1-42-2094-3
Synonyms 3-[2-amino-6-(4-methoxyphenyl)-4-pyrimidinyl]-4-hydroxy-8-methyl-2H-chromen-2-one
Wiley ID 1565285