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Organic oxygen compounds
Description:
Organic compounds that contain one or more oxygen atoms.
Ancestors:
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BICYCLO[3.3.1]NONANE-2,6-DIONECas Number: 16473-11-3 Compound CID: 140084Formula: C9H12O2 Molecular Weight: 152.19IUPAC Name: bicyclo[3.3.1]nonane-2,6-dioneSMILES: C1CC(=O)C2CCC(=O)C1C2InChIKey: QWNPVTXLBMSEPN-UHFFFAOYSA-NInChI: InChI=1S/C9H12O2/c10-8-3-1-6-5-7(8)2-4-9(6)11/h6-7H,1-5H2
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5-(3-FLUOROPHENYL)-5-OXOVALERIC ACIDCas Number: 845790-38-7 Compound CID: 2759127Formula: C11H11FO3 Molecular Weight: 210.21IUPAC Name: 5-(3-fluorophenyl)-5-oxopentanoic acidSMILES: C1=CC(=CC(=C1)F)C(=O)CCCC(=O)OInChIKey: VMDBDUOSNLRJAG-UHFFFAOYSA-NInChI: InChI=1S/C11H11FO3/c12-9-4-1-3-8(7-9)10(13)5-2-6-11(14)15/h1,3-4,7H,2,5-6H2,(H,14,15)
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5-Bromo-4-chloro-2-hydroxybenzaldehydeCas Number: 876492-31-8 Compound CID: 7172121Formula: C7H4BrClO2 Molecular Weight: 235.46IUPAC Name: 5-bromo-4-chloro-2-hydroxybenzaldehydeSMILES: C1=C(C(=CC(=C1Br)Cl)O)C=OInChIKey: JNRYILHFKYOXIK-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrClO2/c8-5-1-4(3-10)7(11)2-6(5)9/h1-3,11H
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4'-Ethoxy-2-methylpropiophenoneCas Number: 72846-63-0Formula: C12H16O2 Molecular Weight: 192.2542SMILES: CCOC1=CC=C(C=C1)C(=O)C(C)CInChIKey: POGPSKUWSGOZRN-UHFFFAOYSA-NInChI: InChI=1S/C12H16O2/c1-4-14-11-7-5-10(6-8-11)12(13)9(2)3/h5-9H,4H2,1-3H3
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3,4-Hexanediol, 3,4-dimethyl-Cas Number: 1185-02-0Formula: C8H18O2 Molecular Weight: 146.2273SMILES: CCC(C)(C(C)(CC)O)OInChIKey: RJOVKNVJGPMWDT-UHFFFAOYSA-NInChI: InChI=1S/C8H18O2/c1-5-7(3,9)8(4,10)6-2/h9-10H,5-6H2,1-4H3
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4-(3-tosyl-2-(tosylmethyl)propanoyl)benzoic acidCas Number: 124243-00-1 Compound CID: 6420086Formula: C25H24O7S2 Molecular Weight: 500.6IUPAC Name: 4-[3-(4-methylphenyl)sulfonyl-2-[(4-methylphenyl)sulfonylmethyl]propanoyl]benzoic acidSMILES: CC1=CC=C(C=C1)S(=O)(=O)CC(CS(=O)(=O)C2=CC=C(C=C2)C)C(=O)C3=CC=C(C=C3)C(=O)OInChIKey: HGOBHXGITKMPPL-UHFFFAOYSA-NInChI: show more
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4-(Hydroxymethyl)cyclohexanecarboxaldehydeCas Number: 92385-32-5Formula: C8H14O2 Molecular Weight: 142.20SMILES: C1CC(CCC1CO)C=OInChIKey: ZMVNSYYBXALPII-UHFFFAOYSA-NInChI: InChI=1S/C8H14O2/c9-5-7-1-2-8(6-10)4-3-7/h5,7-8,10H,1-4,6H2
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3,3-Bis(bromomethyl)-3,4-dihydro-2H-thieno[3,4-b][1,4]dioxepineCas Number: 701209-98-5 Compound CID: 59591622Formula: C9H10Br2O2S Molecular Weight: 342.05IUPAC Name: 3,3-bis(bromomethyl)-2,4-dihydrothieno[3,4-b][1,4]dioxepineSMILES: C1C(COC2=CSC=C2O1)(CBr)CBrInChIKey: JSDPDQPADLMIHM-UHFFFAOYSA-NInChI: InChI=1S/C9H10Br2O2S/c10-3-9(4-11)5-12-7-1-14-2-8(7)13-6-9/h1-2H,3-6H2
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2,5-OctanedioneCas Number: 3214-41-3Formula: C8H14O2 Molecular Weight: 142.1956SMILES: CCCC(=O)CCC(=O)CInChIKey: SPDFSSLYVRCMDZ-UHFFFAOYSA-NInChI: InChI=1S/C8H14O2/c1-3-4-8(10)6-5-7(2)9/h3-6H2,1-2H3
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2,5,8,11,14,17,20,23,26-nonaoxaheptacosaneCas Number: 25990-94-7Formula: C18H38O9 Molecular Weight: 398.4889SMILES: COCCOCCOCCOCCOCCOCCOCCOCCOCInChIKey: HKKZPBCWTDFVFB-UHFFFAOYSA-NInChI: InChI=1S/C18H38O9/c1-19-3-5-21-7-9-23-11-13-25-15-17-27-18-16-26-14-12-24-10-8-22-6-4-20-2/h3-18H2,1-2H3
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2,5-DiacetylfuranCas Number: 38071-72-6Formula: C8H8O3 Molecular Weight: 152.1473SMILES: CC(=O)C1=CC=C(O1)C(=O)CInChIKey: HJULPPMMCXMWJA-UHFFFAOYSA-NInChI: InChI=1S/C8H8O3/c1-5(9)7-3-4-8(11-7)6(2)10/h3-4H,1-2H3
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3'-Methoxy-4'-methylacetophenoneCas Number: 3556-81-8 Compound CID: 10130124Formula: C10H12O2 Molecular Weight: 164.2IUPAC Name: 1-(3-methoxy-4-methylphenyl)ethanoneSMILES: CC1=C(C=C(C=C1)C(=O)C)OCInChIKey: SZYKDYIBUSNYRS-UHFFFAOYSA-NInChI: InChI=1S/C10H12O2/c1-7-4-5-9(8(2)11)6-10(7)12-3/h4-6H,1-3H3
