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N-(phenylmethyl)-2-[[5-[4-(trifluoromethoxy)phenyl]-1-tetrazolyl]thio]acetamide
SpectraBase Compound ID Gufr4y7bZIT
InChI InChI=1S/C17H14F3N5O2S/c18-17(19,20)27-14-8-6-13(7-9-14)16-22-23-24-25(16)28-11-15(26)21-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,21,26)
InChIKey FDGZQVJGXRUHOG-UHFFFAOYSA-N
Mol Weight 409.39 g/mol
Molecular Formula C17H14F3N5O2S
Exact Mass 409.08203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ba75jD5yilL
Name N-(phenylmethyl)-2-[[5-[4-(trifluoromethoxy)phenyl]-1-tetrazolyl]thio]acetamide
Alternate Name(s) N-(phenylmethyl)-2-[[5-[4-(trifluoromethyloxy)phenyl]-1,2,3,4-tetrazol-1-yl]sulfanyl]ethanamide N-benzyl-2-[5-[4-(trifluoromethoxy)phenyl]tetrazol-1-yl]sulfanyl-acetamide N-benzyl-2-[[5-[4-(trifluoromethoxy)phenyl]tetrazol-1-yl]thio]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14F3N5O2S
InChI InChI=1S/C17H14F3N5O2S/c18-17(19,20)27-14-8-6-13(7-9-14)16-22-23-24-25(16)28-11-15(26)21-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,21,26)
InChIKey FDGZQVJGXRUHOG-UHFFFAOYSA-N
Molecular Weight 409.387 g/mol
SMILES N(C(CS[n]1c(nnn1)-c1ccc(OC(F)(F)F)cc1)=O)Cc1ccccc1
SPLASH splash10-00kg-9710000000-b149dd2c08dec59a8261
Wiley ID 1444501