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Phenylketones
Description:
Aromatic compounds containing a ketone substituted by one aryl group.
Ancestors:
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3,4-DimethoxybenzoylacetonitrileCas Number: 4640-69-1 Compound CID: 7022363Formula: C11H11NO3 Molecular Weight: 205.21IUPAC Name: 3-(3,4-dimethoxyphenyl)-3-oxopropanenitrileSMILES: COC1=C(C=C(C=C1)C(=O)CC#N)OCInChIKey: JFSNSYKHZRHIGE-UHFFFAOYSA-NInChI: InChI=1S/C11H11NO3/c1-14-10-4-3-8(7-11(10)15-2)9(13)5-6-12/h3-4,7H,5H2,1-2H3Synonyms: 3,4-Dimethoxybenzoylacetonitrile | (3,4-dimethoxybenzoyl)acetonitrile -
3-(4-Bromo-2-Fluorophenyl)-3-OxopropanenitrileCas Number: 267880-92-2 Compound CID: 24213794Formula: C9H5BrFNO Molecular Weight: 242.04IUPAC Name: 3-(4-bromo-2-fluorophenyl)-3-oxopropanenitrileSMILES: C1=CC(=C(C=C1Br)F)C(=O)CC#NInChIKey: JYQGDFCINOSMOC-UHFFFAOYSA-NInChI: InChI=1S/C9H5BrFNO/c10-6-1-2-7(8(11)5-6)9(13)3-4-12/h1-2,5H,3H2
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2，4-Dihydroxy-6-methoxyacetophenoneCas Number: 3602-54-8 Compound CID: 10965145Formula: C9H10O4 Molecular Weight: 182.17IUPAC Name: 1-(2,4-dihydroxy-6-methoxyphenyl)ethanoneSMILES: CC(=O)C1=C(C=C(C=C1OC)O)OInChIKey: IETZAWFZIAOWQX-UHFFFAOYSA-NInChI: InChI=1S/C9H10O4/c1-5(10)9-7(12)3-6(11)4-8(9)13-2/h3-4,11-12H,1-2H3
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2，2，2-Trifluoro-1-(4-nitrophenyl)ethanoneCas Number: 58808-61-0 Compound CID: 11063926Formula: C8H4F3NO3 Molecular Weight: 219.12IUPAC Name: 2,2,2-trifluoro-1-(4-nitrophenyl)ethanoneSMILES: C1=CC(=CC=C1C(=O)C(F)(F)F)[N+](=O)[O-]InChIKey: WUCSOOFBCSHTCS-UHFFFAOYSA-NInChI: InChI=1S/C8H4F3NO3/c9-8(10,11)7(13)5-1-3-6(4-2-5)12(14)15/h1-4H
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2，2，2-Trifluoro-1-(o-tolyl)ethan-1-oneCas Number: 341-39-9 Compound CID: 13238647Formula: C9H7F3O Molecular Weight: 188.15IUPAC Name: 2,2,2-trifluoro-1-(2-methylphenyl)ethanoneSMILES: CC1=CC=CC=C1C(=O)C(F)(F)FInChIKey: JHQDBQYFKARISA-UHFFFAOYSA-NInChI: InChI=1S/C9H7F3O/c1-6-4-2-3-5-7(6)8(13)9(10,11)12/h2-5H,1H3
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2,6-Dihydroxy-4-methylacetophenoneCas Number: 1634-34-0 Compound CID: 10419531Formula: C9H10O3 Molecular Weight: 166.17IUPAC Name: 1-(2,6-dihydroxy-4-methylphenyl)ethanoneSMILES: CC1=CC(=C(C(=C1)O)C(=O)C)OInChIKey: CUYUORWXJSURNV-UHFFFAOYSA-NInChI: InChI=1S/C9H10O3/c1-5-3-7(11)9(6(2)10)8(12)4-5/h3-4,11-12H,1-2H3Synonyms: 1-(2,6-Dihydroxy-4-methylphenyl)ethan-1-one | 3,5-Dihydroxy-4-acetyltoluene
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2’-Amino-5’-chloro-4’-fluoroacetophenoneCas Number: 937816-85-8 Compound CID: 16221386Formula: C8H7ClFNO Molecular Weight: 187.6IUPAC Name: 1-(2-amino-5-chloro-4-fluorophenyl)ethanoneSMILES: CC(=O)C1=CC(=C(C=C1N)F)ClInChIKey: LEGKWOITIUDBDW-UHFFFAOYSA-NInChI: InChI=1S/C8H7ClFNO/c1-4(12)5-2-6(9)7(10)3-8(5)11/h2-3H,11H2,1H3
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2，2，2-Trifluoro-1-(2-fluorophenyl)ethanoneCas Number: 124004-75-7 Compound CID: 21200933Formula: C8H4F4O Molecular Weight: 192.11IUPAC Name: 2,2,2-trifluoro-1-(2-fluorophenyl)ethanoneSMILES: C1=CC=C(C(=C1)C(=O)C(F)(F)F)FInChIKey: NVSKOJZXIQFFBQ-UHFFFAOYSA-NInChI: InChI=1S/C8H4F4O/c9-6-4-2-1-3-5(6)7(13)8(10,11)12/h1-4H
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2，2，2-Trifluoro-1-(2-(methylamino)phenyl)ethanoneCas Number: 202270-41-5 Compound CID: 23283839Formula: C9H8F3NO Molecular Weight: 203.16IUPAC Name: 2,2,2-trifluoro-1-[2-(methylamino)phenyl]ethanoneSMILES: CNC1=CC=CC=C1C(=O)C(F)(F)FInChIKey: OCBFFMSUNUNWSK-UHFFFAOYSA-NInChI: InChI=1S/C9H8F3NO/c1-13-7-5-3-2-4-6(7)8(14)9(10,11)12/h2-5,13H,1H3
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2-Oxo-2-(p-tolyl)ethyl acetateCas Number: 65143-37-5 Compound CID: 5151332Formula: C11H12O3 Molecular Weight: 192.22IUPAC Name: [2-(4-methylphenyl)-2-oxoethyl] acetateSMILES: CC1=CC=C(C=C1)C(=O)COC(=O)CInChIKey: GMGKFZCRKFZPMC-UHFFFAOYSA-NInChI: InChI=1S/C11H12O3/c1-8-3-5-10(6-4-8)11(13)7-14-9(2)12/h3-6H,7H2,1-2H3
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2-Mercapto-1-phenylethanoneCas Number: 2462-02-4 Compound CID: 11073609Formula: C8H8OS Molecular Weight: 152.22IUPAC Name: 1-phenyl-2-sulfanylethanoneSMILES: C1=CC=C(C=C1)C(=O)CSInChIKey: DIYFBIOUBFTQJU-UHFFFAOYSA-NInChI: InChI=1S/C8H8OS/c9-8(6-10)7-4-2-1-3-5-7/h1-5,10H,6H2
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2-Cyclopropyl-1-phenylethanoneCas Number: 6739-22-6 Compound CID: 12492604Formula: C11H12O Molecular Weight: 160.21IUPAC Name: 2-cyclopropyl-1-phenylethanoneSMILES: C1CC1CC(=O)C2=CC=CC=C2InChIKey: SKAMSFNTWGMHJW-UHFFFAOYSA-NInChI: InChI=1S/C11H12O/c12-11(8-9-6-7-9)10-4-2-1-3-5-10/h1-5,9H,6-8H2
