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2-([(2,5-Dimethoxyphenyl)sulfanyl]methyl)-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole

View entire compound with spectra: 1 MS (GC)

2-([(2,5-Dimethoxyphenyl)sulfanyl]methyl)-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole
SpectraBase Compound ID DbM6ASWx7sm
InChI InChI=1S/C18H17N3O5S/c1-11-8-12(4-6-14(11)21(22)23)18-20-19-17(26-18)10-27-16-9-13(24-2)5-7-15(16)25-3/h4-9H,10H2,1-3H3
InChIKey QGXQJVFVOYVYDD-UHFFFAOYSA-N
Mol Weight 387.41 g/mol
Molecular Formula C18H17N3O5S
Exact Mass 387.088892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ac2ei4oNorz
Name 2-([(2,5-Dimethoxyphenyl)sulfanyl]methyl)-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole
CAS Registry Number 298187-57-2
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N3O5S
InChI InChI=1S/C18H17N3O5S/c1-11-8-12(4-6-14(11)21(22)23)18-20-19-17(26-18)10-27-16-9-13(24-2)5-7-15(16)25-3/h4-9H,10H2,1-3H3
InChIKey QGXQJVFVOYVYDD-UHFFFAOYSA-N
Molecular Weight 387.410 g/mol
SMILES COc1cc(SCc2oc(nn2)-c2ccc(N(=O)=O)c(c2)C)c(cc1)OC
SPLASH splash10-06di-5901000000-d42a1134cd0f10b0193e
Source of Spectrum AD-0-2532-0
Synonyms 1,3,4-Oxadiazole, 2-(2,5-dimethoxyphenylthiomethyl)-5-(3-methyl-4-nitrophenyl)- 2-[[(2,5-dimethoxyphenyl)thio]methyl]-5-(3-methyl-4-nitro-phenyl)-1,3,4-oxadiazole 2-[[(2,5-dimethoxyphenyl)thio]methyl]-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole 2-[(2,5-dimethoxyphenyl)sulfanylmethyl]-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole
Wiley ID 1430242