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2-{.alpha.-[N-(3'-Chlorophenyl)amino]-(4"-methoxybenzyl)}-cyclohexanone
SpectraBase Compound ID 8nX1thfvs3l
InChI InChI=1S/C20H22ClNO2/c1-24-17-11-9-14(10-12-17)20(18-7-2-3-8-19(18)23)22-16-6-4-5-15(21)13-16/h4-6,9-13,18,20,22H,2-3,7-8H2,1H3
InChIKey QXWDIUVUYCOTHU-UHFFFAOYSA-N
Mol Weight 343.85 g/mol
Molecular Formula C20H22ClNO2
Exact Mass 343.133907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GrCm4v6UM8T
Name 2-{.alpha.-[N-(3'-Chlorophenyl)amino]-(4"-methoxybenzyl)}-cyclohexanone
Alternate Name(s) 2-[(3-chloroanilino)(4-methoxyphenyl)methyl]cyclohexanone 2-{.alpha.-[N-(3'-Chlorophenyl)amino]-(4''-methoxybenzyl)}-cyclohexanone
Comments Less than 3 mono-isotopic peaks
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Formula C20H22ClNO2
InChI InChI=1S/C20H22ClNO2/c1-24-17-11-9-14(10-12-17)20(18-7-2-3-8-19(18)23)22-16-6-4-5-15(21)13-16/h4-6,9-13,18,20,22H,2-3,7-8H2,1H3
InChIKey QXWDIUVUYCOTHU-UHFFFAOYSA-N
Molecular Weight 343.854 g/mol
SMILES N(C(C1C(=O)CCCC1)c1ccc(cc1)OC)c1cc(Cl)ccc1
SPLASH splash10-0002-0090000000-6f00068dd22b2ef4c4ff
Source of Spectrum OP-23-675-1
Wiley ID 850276