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1H-1,2,3,4-Tetrazole-1-propanamide, N-[3,5-bis(trifluoromethyl)phenyl]-
SpectraBase Compound ID G5YMbzY8NbI
InChI InChI=1S/C12H9F6N5O/c13-11(14,15)7-3-8(12(16,17)18)5-9(4-7)20-10(24)1-2-23-6-19-21-22-23/h3-6H,1-2H2,(H,20,24)
InChIKey YSHSZTXYFVKYNP-UHFFFAOYSA-N
Mol Weight 353.23 g/mol
Molecular Formula C12H9F6N5O
Exact Mass 353.071129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1X2JZzzAmfX
Name 1H-1,2,3,4-Tetrazole-1-propanamide, N-[3,5-bis(trifluoromethyl)phenyl]-
Alternate Name(s) N-[3,5-bis(trifluoromethyl)phenyl]-3-(1,2,3,4-tetrazol-1-yl)propanamide N-[3,5-bis(trifluoromethyl)phenyl]-3-(1-tetrazolyl)propanamide N-[3,5-bis(trifluoromethyl)phenyl]-3-(tetrazol-1-yl)propanamide N-[3,5-bis(trifluoromethyl)phenyl]-3-(tetrazol-1-yl)propionamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F6N5O
InChI InChI=1S/C12H9F6N5O/c13-11(14,15)7-3-8(12(16,17)18)5-9(4-7)20-10(24)1-2-23-6-19-21-22-23/h3-6H,1-2H2,(H,20,24)
InChIKey YSHSZTXYFVKYNP-UHFFFAOYSA-N
Molecular Weight 353.228 g/mol
SMILES N(C(CC[n]1nnnc1)=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
SPLASH splash10-0a4i-9220000000-224ee34c0520471e5b83
Wiley ID 1449534