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4,5-Dichloro-2-[3-(N-dimethylamino)-1-oxopropyl]phenol
SpectraBase Compound ID 2HjXAV4eK4k
InChI InChI=1S/C11H13Cl2NO2/c1-14(2)4-3-10(15)7-5-8(12)9(13)6-11(7)16/h5-6,16H,3-4H2,1-2H3
InChIKey GQVHCPIHHJIVTL-UHFFFAOYSA-N
Mol Weight 262.14 g/mol
Molecular Formula C11H13Cl2NO2
Exact Mass 261.032334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K43gXiBTbn3
Name 4,5-Dichloro-2-[3-(N-dimethylamino)-1-oxopropyl]phenol
Alternate Name(s) 1-(4,5-dichloro-2-hydroxyphenyl)-3-(dimethylamino)-1-propanone
Comments Removed - expert review: contamination (acetone))
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Formula C11H13Cl2NO2
InChI InChI=1S/C11H13Cl2NO2/c1-14(2)4-3-10(15)7-5-8(12)9(13)6-11(7)16/h5-6,16H,3-4H2,1-2H3
InChIKey GQVHCPIHHJIVTL-UHFFFAOYSA-N
Molecular Weight 262.136 g/mol
SMILES Oc1c(cc(c(Cl)c1)Cl)C(CCN(C)C)=O
SPLASH splash10-0a4i-9000000000-3a55ebb6ba14ed6869ee
Source of Spectrum SO-0-710-7
Wiley ID 1540983