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4-Acetamido-1-(2,2,2-trifluoroethyl)-4,5-dihydro-1H-1,2,3-triazole
SpectraBase Compound ID 8XsfZx4AqnB
InChI InChI=1S/C6H9F3N4O/c1-4(14)10-5-2-13(12-11-5)3-6(7,8)9/h5H,2-3H2,1H3,(H,10,14)
InChIKey PYKYKXSZVRPZNI-UHFFFAOYSA-N
Mol Weight 210.16 g/mol
Molecular Formula C6H9F3N4O
Exact Mass 210.072845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Dpsvv2okeG
Name 4-Acetamido-1-(2,2,2-trifluoroethyl)-4,5-dihydro-1H-1,2,3-triazole
Alternate Name(s) N-(1-(2,2,2-trifluoroethyl)-4,5-dihydro-1H-1,2,3-triazol-4-yl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9F3N4O
InChI InChI=1S/C6H9F3N4O/c1-4(14)10-5-2-13(12-11-5)3-6(7,8)9/h5H,2-3H2,1H3,(H,10,14)
InChIKey PYKYKXSZVRPZNI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200890339
Molecular Weight 210.160 g/mol
SMILES N(C(C)=O)C1N=NN(C1)CC(F)(F)F
SPLASH splash10-052f-9000000000-eac7087819e4917043c5
Source of Spectrum CJC-26-1890-3bc
Wiley ID 1772132