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3-Methyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
SpectraBase Compound ID HDyqLJ4tNue
InChI InChI=1S/C7H9F3N2/c1-5-4-11-3-2-6(12-5)7(8,9)10/h2-3,5,11H,4H2,1H3
InChIKey LJABSXGQJPKZGZ-UHFFFAOYSA-N
Mol Weight 178.16 g/mol
Molecular Formula C7H9F3N2
Exact Mass 178.071783 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QcHdEDJr6
Name 3-Methyl-5-(trifluoromethyl)-2,3-dihydro-1,4-diazepine
Alternate Name(s) 3-Methyl-5-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9F3N2
InChI InChI=1S/C7H9F3N2/c1-5-4-11-3-2-6(12-5)7(8,9)10/h2-3,5,11H,4H2,1H3
InChIKey LJABSXGQJPKZGZ-UHFFFAOYSA-N
Molecular Weight 178.158 g/mol
SMILES N1C=CC(=NC(C1)C)C(F)(F)F
SPLASH splash10-004r-0900000000-b10c177da207108fad1b
Source of Spectrum SK-30-684-5
Wiley ID 881142