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Benzamide, N-[4-(2H-1,2,3-benzotriazol-2-yl)phenyl]-2,4-dichloro-N-(1-methylethyl)-
SpectraBase Compound ID BIlqjsuslYB
InChI InChI=1S/C22H18Cl2N4O/c1-14(2)27(22(29)18-12-7-15(23)13-19(18)24)16-8-10-17(11-9-16)28-25-20-5-3-4-6-21(20)26-28/h3-14H,1-2H3
InChIKey RMBYGTZXMVRFJP-UHFFFAOYSA-N
Mol Weight 425.32 g/mol
Molecular Formula C22H18Cl2N4O
Exact Mass 424.085767 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGGBOPg2fAm
Name Benzamide, N-[4-(2H-1,2,3-benzotriazol-2-yl)phenyl]-2,4-dichloro-N-(1-methylethyl)-
Comments Computed using HOSE algorithm
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Exact Mass 424.085766615 u
Formula C22H18Cl2N4O
InChI InChI=1S/C22H18Cl2N4O/c1-14(2)27(22(29)18-12-7-15(23)13-19(18)24)16-8-10-17(11-9-16)28-25-20-5-3-4-6-21(20)26-28/h3-14H,1-2H3
InChIKey RMBYGTZXMVRFJP-UHFFFAOYSA-N
Molecular Weight 425.319 g/mol
SMILES C1(=CC=C(C(=C1)Cl)C(N(C1=CC=C(C=C1)N1N=C2C=CC=CC2=N1)C(C)C)=O)Cl