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Benzamide, 2-chloro-N-(2-chlorobenzoyl)-N-octyl-
SpectraBase Compound ID 8101h5Vc9io
InChI InChI=1S/C22H25Cl2NO2/c1-2-3-4-5-6-11-16-25(21(26)17-12-7-9-14-19(17)23)22(27)18-13-8-10-15-20(18)24/h7-10,12-15H,2-6,11,16H2,1H3
InChIKey RXBIQKQFQROWJQ-UHFFFAOYSA-N
Mol Weight 406.35 g/mol
Molecular Formula C22H25Cl2NO2
Exact Mass 405.126234 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GQ4xZPffMnH
Name Benzamide, 2-chloro-N-(2-chlorobenzoyl)-N-octyl-
Comments Computed using HOSE algorithm
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Exact Mass 405.126234447 u
Formula C22H25Cl2NO2
InChI InChI=1S/C22H25Cl2NO2/c1-2-3-4-5-6-11-16-25(21(26)17-12-7-9-14-19(17)23)22(27)18-13-8-10-15-20(18)24/h7-10,12-15H,2-6,11,16H2,1H3
InChIKey RXBIQKQFQROWJQ-UHFFFAOYSA-N
Molecular Weight 406.353 g/mol
SMILES C(N(CCCCCCCC)C(C1=C(C=CC=C1)Cl)=O)(=O)C=1C=CC=CC1Cl