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3-(3,4,5-trimethoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazole
SpectraBase Compound ID DitqBgzxscj
InChI InChI=1S/C21H25N3O6/c1-25-14-7-12(8-15(26-2)19(14)29-5)9-18-22-21(24-23-18)13-10-16(27-3)20(30-6)17(11-13)28-4/h7-8,10-11H,9H2,1-6H3,(H,22,23,24)
InChIKey QBSACYYLSQOEEQ-UHFFFAOYSA-N
Mol Weight 415.45 g/mol
Molecular Formula C21H25N3O6
Exact Mass 415.174336 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IxHtSVUxRH
Name 3-(3,4,5-trimethoxyphenyl)-5-[(3,4,5-trimethoxyphenyl)methyl]-1H-1,2,4-triazole
Alternate Name(s) 5-(3,4,5-trimethoxybenzyl)-3-(3,4,5-trimethoxyphenyl)-1H-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25N3O6
InChI InChI=1S/C21H25N3O6/c1-25-14-7-12(8-15(26-2)19(14)29-5)9-18-22-21(24-23-18)13-10-16(27-3)20(30-6)17(11-13)28-4/h7-8,10-11H,9H2,1-6H3,(H,22,23,24)
InChIKey QBSACYYLSQOEEQ-UHFFFAOYSA-N
Molecular Weight 415.446 g/mol
SMILES [nH]1nc(nc1Cc1cc(OC)c(c(c1)OC)OC)-c1cc(OC)c(c(c1)OC)OC
SPLASH splash10-0gb9-0000900000-862bbb4e00cfe3987a33
Source of Spectrum Y-28-1201-7
Wiley ID 1375948