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N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
SpectraBase Compound ID 4PPeD3UXzDo
InChI InChI=1S/C22H27N5O3S/c1-4-29-19-11-6-16(14-20(19)30-5-2)12-13-23-21(28)15-27-25-22(24-26-27)17-7-9-18(31-3)10-8-17/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,28)
InChIKey QXCYAFMSOWHQTO-UHFFFAOYSA-N
Mol Weight 441.55 g/mol
Molecular Formula C22H27N5O3S
Exact Mass 441.183461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzWNKeF9kkq
Name N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
Alternate Name(s) N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-[4-(methylthio)phenyl]-2-tetrazolyl]acetamide N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-[4-(methylthio)phenyl]tetrazol-2-yl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27N5O3S
InChI InChI=1S/C22H27N5O3S/c1-4-29-19-11-6-16(14-20(19)30-5-2)12-13-23-21(28)15-27-25-22(24-26-27)17-7-9-18(31-3)10-8-17/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,28)
InChIKey QXCYAFMSOWHQTO-UHFFFAOYSA-N
Molecular Weight 441.550 g/mol
SMILES N(C(C[n]1nc(nn1)-c1ccc(cc1)SC)=O)CCc1cc(OCC)c(cc1)OCC
SPLASH splash10-0005-2910000000-89ebe8d73f54d99bba8b
Wiley ID 1442641