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5-(3,4-Dimethoxybenzyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
SpectraBase Compound ID KKKJZeDdpbk
InChI InChI=1S/C21H19N3O3/c1-25-18-10-5-15(13-19(18)26-2)14-20-22-21(23-27-20)16-6-8-17(9-7-16)24-11-3-4-12-24/h3-13H,14H2,1-2H3
InChIKey XGMVNTALRMPIGY-UHFFFAOYSA-N
Mol Weight 361.4 g/mol
Molecular Formula C21H19N3O3
Exact Mass 361.142641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3WGTG8RqOSs
Name 5-(3,4-Dimethoxybenzyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O3
InChI InChI=1S/C21H19N3O3/c1-25-18-10-5-15(13-19(18)26-2)14-20-22-21(23-27-20)16-6-8-17(9-7-16)24-11-3-4-12-24/h3-13H,14H2,1-2H3
InChIKey XGMVNTALRMPIGY-UHFFFAOYSA-N
Molecular Weight 361.401 g/mol
SMILES COc1ccc(cc1OC)Cc1nc(no1)-c1ccc(-[n]2cccc2)cc1
SPLASH splash10-0udi-3901000000-c51362733b73d87fbcc6
Synonyms 3-(4-pyrrol-1-ylphenyl)-5-veratryl-1,2,4-oxadiazole 5-[(3,4-dimethoxyphenyl)methyl]-3-(4-pyrrol-1-ylphenyl)-1,2,4-oxadiazole 5-[(3,4-dimethoxyphenyl)methyl]-3-[4-(1-pyrrolyl)phenyl]-1,2,4-oxadiazole [1,2,4]Oxadiazole, 5-(3,4-dimethoxybenzyl)-3-(4-pyrrol-1-ylphenyl)-
Wiley ID 1447596