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7-Nitro-3-trifluoroacetyl-2-trifluoromethyl-(1H,5)benzodiazepine
SpectraBase Compound ID AnsnwUIMZXI
InChI InChI=1S/C12H5F6N3O3/c13-11(14,15)9-6(10(22)12(16,17)18)4-19-8-3-5(21(23)24)1-2-7(8)20-9/h1-4,20H
InChIKey UZCCHQLWHZSVHC-UHFFFAOYSA-N
Mol Weight 353.18 g/mol
Molecular Formula C12H5F6N3O3
Exact Mass 353.02351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gTyJCGlunr
Name 7-Nitro-3-trifluoroacetyl-2-trifluoromethyl-(1H,5)benzodiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H5F6N3O3
InChI InChI=1S/C12H5F6N3O3/c13-11(14,15)9-6(10(22)12(16,17)18)4-19-8-3-5(21(23)24)1-2-7(8)20-9/h1-4,20H
InChIKey UZCCHQLWHZSVHC-UHFFFAOYSA-N
Molecular Weight 353.180 g/mol
SMILES N1c2ccc(cc2N=CC(=C1C(F)(F)F)C(C(F)(F)F)=O)[N+]([O-])=O
SPLASH splash10-03di-1901000000-08d8feaa1cbb131a2c3a
Source of Spectrum F-53-5852-7a
Wiley ID 801781