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7-Chloro-1-(2-diethylaminoethyl)-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one dihydrochloride

View entire compound with spectra: 1 MS (GC)

7-Chloro-1-(2-diethylaminoethyl)-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one dihydrochloride
SpectraBase Compound ID KWn2MWlgzT
InChI InChI=1S/C21H23ClFN3O.2Cl/c1-3-25(4-2)11-12-26-19-10-9-15(22)13-17(19)21(24-14-20(26)27)16-7-5-6-8-18(16)23;;/h5-10,13H,3-4,11-12,14H2,1-2H3;;
InChIKey QUUQAPZVFSYMRT-UHFFFAOYSA-N
Mol Weight 458.79 g/mol
Molecular Formula C21H23Cl3FN3O
Exact Mass 457.089074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nLk8akx1QU
Name 7-Chloro-1-(2-diethylaminoethyl)-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one dihydrochloride
Alternate Name(s) 7-Chloranyl-1-[2-(diethylamino)ethyl]-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one;dihydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25Cl3FN3O
InChI InChI=1S/C21H23ClFN3O.2Cl/c1-3-25(4-2)11-12-26-19-10-9-15(22)13-17(19)21(24-14-20(26)27)16-7-5-6-8-18(16)23;;/h5-10,13H,3-4,11-12,14H2,1-2H3;;
InChIKey QUUQAPZVFSYMRT-UHFFFAOYSA-N
Molecular Weight 460.808 g/mol
SMILES Cl.c12c(cc(Cl)cc2)C(=NCC(N1CCN(CC)CC)=O)c1c(F)cccc1.Cl
SPLASH splash10-000i-9100000000-69e27352da6fc538f354
Wiley ID 1477886