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N-(2-butoxyphenyl)-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide

View entire compound with spectra: 1 MS (GC)

N-(2-butoxyphenyl)-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
SpectraBase Compound ID FIs3W04s0Gi
InChI InChI=1S/C20H23N5O2S/c1-3-4-13-27-18-8-6-5-7-17(18)21-19(26)14-25-23-20(22-24-25)15-9-11-16(28-2)12-10-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,26)
InChIKey WQCFUSFXUDVPEL-UHFFFAOYSA-N
Mol Weight 397.5 g/mol
Molecular Formula C20H23N5O2S
Exact Mass 397.157246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lcQxK4q0GP
Name N-(2-butoxyphenyl)-2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanamide
Alternate Name(s) N-(2-butoxyphenyl)-2-[5-[4-(methylthio)phenyl]-2-tetrazolyl]acetamide N-(2-butoxyphenyl)-2-[5-[4-(methylthio)phenyl]tetrazol-2-yl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N5O2S
InChI InChI=1S/C20H23N5O2S/c1-3-4-13-27-18-8-6-5-7-17(18)21-19(26)14-25-23-20(22-24-25)15-9-11-16(28-2)12-10-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,26)
InChIKey WQCFUSFXUDVPEL-UHFFFAOYSA-N
Molecular Weight 397.497 g/mol
SMILES N(C(C[n]1nc(nn1)-c1ccc(SC)cc1)=O)c1c(OCCCC)cccc1
SPLASH splash10-000t-4900000000-54b7fe2261b3e6f16a13
Wiley ID 1443996