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5-(4-chlorophenyl)-7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-(4-chlorophenyl)-7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
SpectraBase Compound ID BL5Qbbpn1Tw
InChI InChI=1S/C12H10ClF3N2/c13-9-3-1-8(2-4-9)10-7-11(12(14,15)16)18-6-5-17-10/h1-4,7,18H,5-6H2
InChIKey CYXMAITUYBZRHY-UHFFFAOYSA-N
Mol Weight 274.67 g/mol
Molecular Formula C12H10ClF3N2
Exact Mass 274.048461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8xc0GdwGcj
Name 5-(4-Chlorophenyl)-7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10ClF3N2
InChI InChI=1S/C12H10ClF3N2/c13-9-3-1-8(2-4-9)10-7-11(12(14,15)16)18-6-5-17-10/h1-4,7,18H,5-6H2
InChIKey CYXMAITUYBZRHY-UHFFFAOYSA-N
Molecular Weight 274.674 g/mol
SMILES N1CCN=C(C=C1C(F)(F)F)c1ccc(cc1)Cl
SPLASH splash10-00di-0290000000-43d1d1fb6bddcbf0a104
Source of Spectrum AH-127-1015-5
Wiley ID 1277718