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3,6-Dihydro-3,6-diphenyl-5-(4-methoxyphenoxy)-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
SpectraBase Compound ID FkXT7e2n5Da
InChI InChI=1S/C23H17N5O3/c1-30-18-12-14-19(15-13-18)31-23-24-21-20(22(29)27(23)16-8-4-2-5-9-16)25-26-28(21)17-10-6-3-7-11-17/h2-15H,1H3
InChIKey GVDKVTLLXZSQLB-UHFFFAOYSA-N
Mol Weight 411.42 g/mol
Molecular Formula C23H17N5O3
Exact Mass 411.133139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SuAhg1yhTS
Name 3,6-Dihydro-3,6-diphenyl-5-(4-methoxyphenoxy)-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
Alternate Name(s) 5-(4-Methoxyphenoxy)-3,6-diphenyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17N5O3
InChI InChI=1S/C23H17N5O3/c1-30-18-12-14-19(15-13-18)31-23-24-21-20(22(29)27(23)16-8-4-2-5-9-16)25-26-28(21)17-10-6-3-7-11-17/h2-15H,1H3
InChIKey GVDKVTLLXZSQLB-UHFFFAOYSA-N
Molecular Weight 411.421 g/mol
SMILES C1(=Nc2c(C(N1c1ccccc1)=O)nn[n]2-c1ccccc1)Oc1ccc(cc1)OC
SPLASH splash10-004i-9100000000-8846ce3d25d66a8e04e3
Source of Spectrum F4-0-2547-4
Wiley ID 1618715