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1-(4'-Methoxybiphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one
SpectraBase Compound ID CuLiFpdQK0K
InChI InChI=1S/C21H23N3O3/c1-21(2,3)19(25)20(24-14-22-13-23-24)27-18-11-7-16(8-12-18)15-5-9-17(26-4)10-6-15/h5-14,20H,1-4H3
InChIKey LPYPEYDPXRZDMF-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C21H23N3O3
Exact Mass 365.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EwPKyVcx3zI
Name 1-(4'-Methoxybiphenyl-4-yloxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one
Alternate Name(s) 1-((4'-methoxy-[1,1'-biphenyl]-4-yl)oxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O3
InChI InChI=1S/C21H23N3O3/c1-21(2,3)19(25)20(24-14-22-13-23-24)27-18-11-7-16(8-12-18)15-5-9-17(26-4)10-6-15/h5-14,20H,1-4H3
InChIKey LPYPEYDPXRZDMF-UHFFFAOYSA-N
Molecular Weight 365.433 g/mol
SMILES C([n]1ncnc1)(C(C(C)(C)C)=O)Oc1ccc(-c2ccc(cc2)OC)cc1
SPLASH splash10-0002-1921000000-e3a3069971216be4eb74
Source of Spectrum F-70-284-12
Wiley ID 1742463