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5-[bis(2-chloroethyl)amino]-2,4-bis[(2,2,2-trifluoro-1-oxoethyl)amino]benzamide
SpectraBase Compound ID 8LVUUI9dWhT
InChI InChI=1S/C15H14Cl2F6N4O3/c16-1-3-27(4-2-17)10-5-7(11(24)28)8(25-12(29)14(18,19)20)6-9(10)26-13(30)15(21,22)23/h5-6H,1-4H2,(H2,24,28)(H,25,29)(H,26,30)
InChIKey POVSOVVPIMVKHT-UHFFFAOYSA-N
Mol Weight 483.2 g/mol
Molecular Formula C15H14Cl2F6N4O3
Exact Mass 482.034715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10ODu0wwyW
Name 5-[bis(2-chloroethyl)amino]-2,4-bis[(2,2,2-trifluoro-1-oxoethyl)amino]benzamide
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Formula C15H14Cl2F6N4O3
InChI InChI=1S/C15H14Cl2F6N4O3/c16-1-3-27(4-2-17)10-5-7(11(24)28)8(25-12(29)14(18,19)20)6-9(10)26-13(30)15(21,22)23/h5-6H,1-4H2,(H2,24,28)(H,25,29)(H,26,30)
InChIKey POVSOVVPIMVKHT-UHFFFAOYSA-N
Molecular Weight 483.198 g/mol
SMILES N(c1c(cc(c(c1)NC(C(F)(F)F)=O)C(=O)N)N(CCCl)CCCl)C(C(F)(F)F)=O
SPLASH splash10-014l-0000900000-dc216855b5f8dbaf5704
Source of Spectrum E1-38-1237-16
Synonyms 5-[bis(2-chloroethyl)amino]-2,4-bis[(2,2,2-trifluoroacetyl)amino]benzamide 5-[bis(2-chloroethyl)amino]-2,4-bis[2,2,2-tris(fluoranyl)ethanoylamino]benzamide
Wiley ID 1598253