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Furanones
Description:
Compounds containing a furan ring bearing a ketone group.
Ancestors:
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3，4，5-Trimethyl-2(5H)-furanoneCas Number: 33488-51-6Formula: C7H10O2 Molecular Weight: 126.1531SMILES: CC1C(=C(C(=O)O1)C)CInChIKey: OSFZDFIHIYXIEL-UHFFFAOYSA-NInChI: InChI=1S/C7H10O2/c1-4-5(2)7(8)9-6(4)3/h6H,1-3H3 -
2(5H)-Furanone， 3-acetyl-4，5，5-trimethyl-Cas Number: 13156-10-0Formula: C9H12O3 Molecular Weight: 168.1898SMILES: CC1=C(C(=O)OC1(C)C)C(=O)CInChIKey: FKCLNCHKLVJVFS-UHFFFAOYSA-NInChI: InChI=1S/C9H12O3/c1-5-7(6(2)10)8(11)12-9(5,3)4/h1-4H3
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Dihydro-2，2-dimethyl-5-phenyl-3(2H)-furanoneCas Number: 63678-00-2Formula: C12H14O2 Molecular Weight: 190.2384SMILES: CC1(C(=O)CC(O1)C2=CC=CC=C2)CInChIKey: BPOHJJWGUCBNFI-UHFFFAOYSA-NInChI: InChI=1S/C12H14O2/c1-12(2)11(13)8-10(14-12)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3
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5-Pentyl-2(5H)-FuranoneCas Number: 21963-26-8Formula: C9H14O2 Molecular Weight: 154.2063SMILES: CCCCCC1C=CC(=O)O1InChIKey: MXZSZHJBUODOJK-UHFFFAOYSA-NInChI: InChI=1S/C9H14O2/c1-2-3-4-5-8-6-7-9(10)11-8/h6-8H,2-5H2,1H3
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3-(Hydroxymethyl)-4-methylfuran-2，5-dioneCas Number: 245124-18-9 Compound CID: 15882750Formula: C6H6O4 Molecular Weight: 142.11IUPAC Name: 3-(hydroxymethyl)-4-methylfuran-2,5-dioneSMILES: CC1=C(C(=O)OC1=O)COInChIKey: WCLKACFLUOXLDN-UHFFFAOYSA-NInChI: InChI=1S/C6H6O4/c1-3-4(2-7)6(9)10-5(3)8/h7H,2H2,1H3
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3-(Trifluoromethyl)furan-2,5-dioneCas Number: 700-27-6 Compound CID: 2777531Formula: C5HF3O3 Molecular Weight: 166.06IUPAC Name: 3-(trifluoromethyl)furan-2,5-dioneSMILES: C1=C(C(=O)OC1=O)C(F)(F)FInChIKey: YBZPZJWPSHBGOR-UHFFFAOYSA-NInChI: InChI=1S/C5HF3O3/c6-5(7,8)2-1-3(9)11-4(2)10/h1H
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Vulpinic AcidFormula: C19H14O5 Molecular Weight: 322.31IUPAC Name: methyl (2E)-2-(3-hydroxy-5-oxo-4-phenylfuran-2-ylidene)-2-phenylacetateSMILES: COC(=O)C(=C1C(=C(C(=O)O1)C2=CC=CC=C2)O)C3=CC=CC=C3InChIKey: OMZRMXULWNMRAE-BMRADRMJSA-NInChI: InChI=1S/C19H14O5/c1-23-18(21)15(13-10-6-3-7-11-13)17-16(20)14(19(22)24-17)12-8-4-2-5-9-12/h2-11,20H,1H3/b17-15+
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5，5-diMethyldihydrofuran-3(2H)-oneIUPAC Name: 5,5-dimethyloxolan-3-oneSMILES: CC1(CC(=O)CO1)CInChIKey: FJIZZBSPJHPCAY-UHFFFAOYSA-NInChI: InChI=1S/C6H10O2/c1-6(2)3-5(7)4-8-6/h3-4H2,1-2H3
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5-Hydroxy-4-propylfuran-2(5H)-oneCas Number: 78920-10-2 Compound CID: 12864800Formula: C7H10O3 Molecular Weight: 142.15IUPAC Name: 2-hydroxy-3-propyl-2H-furan-5-oneSMILES: CCCC1=CC(=O)OC1OInChIKey: KQMCGGGTJKNIMC-UHFFFAOYSA-NInChI: InChI=1S/C7H10O3/c1-2-3-5-4-6(8)10-7(5)9/h4,7,9H,2-3H2,1H3
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4-Chloro-5-hydroxyfuran-2(5H)-oneCas Number: 40636-99-5 Compound CID: 10986279Formula: C4H3ClO3 Molecular Weight: 134.52IUPAC Name: 3-chloro-2-hydroxy-2H-furan-5-oneSMILES: C1=C(C(OC1=O)O)ClInChIKey: PVHSTWIOXQEZNB-UHFFFAOYSA-NInChI: InChI=1S/C4H3ClO3/c5-2-1-3(6)8-4(2)7/h1,4,7H
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3-(Bromomethyl)-4-methylfuran-2,5-dioneCas Number: 98453-81-7 Compound CID: 11063565Formula: C6H5BrO3 Molecular Weight: 205.01IUPAC Name: 3-(bromomethyl)-4-methylfuran-2,5-dioneSMILES: CC1=C(C(=O)OC1=O)CBrInChIKey: AVTAKKPVKDWUEY-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrO3/c1-3-4(2-7)6(9)10-5(3)8/h2H2,1H3
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3，4-Dichloro-5-hydroxyfuran-2(5H)-oneCas Number: 766-40-5 Compound CID: 91487Formula: C4H2Cl2O3 Molecular Weight: 168.96IUPAC Name: 3,4-dichloro-2-hydroxy-2H-furan-5-oneSMILES: C1(C(=C(C(=O)O1)Cl)Cl)OInChIKey: ZAKLKBFCSHJIRI-UHFFFAOYSA-NInChI: InChI=1S/C4H2Cl2O3/c5-1-2(6)4(8)9-3(1)7/h3,7H
