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2-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)benzyl]acetamide
SpectraBase Compound ID CfwI0tvTJuV
InChI InChI=1S/C13H13F3N4OS/c1-20-8-18-19-12(20)22-7-11(21)17-6-9-3-2-4-10(5-9)13(14,15)16/h2-5,8H,6-7H2,1H3,(H,17,21)
InChIKey SGRVEQOPMCNSNJ-UHFFFAOYSA-N
Mol Weight 330.33 g/mol
Molecular Formula C13H13F3N4OS
Exact Mass 330.076217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AeukVhMBqnz
Name 2-[(4-Methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)benzyl]acetamide
Alternate Name(s) 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamide 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[3-(trifluoromethyl)benzyl]acetamide 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide Acetamide, N-(3-trifluoromethylbenzyl)-2-(4-methyl-4H-1,2,4-triazol-3-ylthio)-
CAS Registry Number 351060-74-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13F3N4OS
InChI InChI=1S/C13H13F3N4OS/c1-20-8-18-19-12(20)22-7-11(21)17-6-9-3-2-4-10(5-9)13(14,15)16/h2-5,8H,6-7H2,1H3,(H,17,21)
InChIKey SGRVEQOPMCNSNJ-UHFFFAOYSA-N
Molecular Weight 330.329 g/mol
SMILES N(C(CSc1[n](cnn1)C)=O)Cc1cc(C(F)(F)F)ccc1
SPLASH splash10-05ru-6900000000-9aeb0e1f815da5e108d9
Source of Spectrum AD-0-2532-0
Wiley ID 1433127