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Ketals
Description:
Acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals.
Ancestors:
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Cyclohexanone trimethylene acetalCas Number: 180-93-8Formula: C9H16O2 Molecular Weight: 156.2221SMILES: C1CCC2(CC1)OCCCO2InChIKey: LSDTWMHYCLFXBZ-UHFFFAOYSA-NInChI: InChI=1S/C9H16O2/c1-2-5-9(6-3-1)10-7-4-8-11-9/h1-8H2 -
1，5-Dioxaspiro[5.5]undecane，3，3-dimethyl-Cas Number: 707-29-9Formula: C11H20O2 Molecular Weight: 184.2753SMILES: CC1(COC2(CCCCC2)OC1)CInChIKey: QIFSGRPJUXQGMD-UHFFFAOYSA-NInChI: InChI=1S/C11H20O2/c1-10(2)8-12-11(13-9-10)6-4-3-5-7-11/h3-9H2,1-2H3
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5-Ethyl-2，2-dimethyl-1，3-dioxane-5-carboxylic acidCas Number: 587874-07-5 Compound CID: 85858854Formula: C9H16O4 Molecular Weight: 188.22IUPAC Name: 5-ethyl-2,2-dimethyl-1,3-dioxane-5-carboxylic acidSMILES: CCC1(COC(OC1)(C)C)C(=O)OInChIKey: PPCPSAJTFINMRX-UHFFFAOYSA-NInChI: InChI=1S/C9H16O4/c1-4-9(7(10)11)5-12-8(2,3)13-6-9/h4-6H2,1-3H3,(H,10,11)
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2，2-DIMETHOXY-PROPANE-1，3-DIOLCas Number: 153214-82-5 Compound CID: 11126310Formula: C5H12O4 Molecular Weight: 136.14IUPAC Name: 2,2-dimethoxypropane-1,3-diolSMILES: COC(CO)(CO)OCInChIKey: HYRZFKCRTXTLLZ-UHFFFAOYSA-NInChI: InChI=1S/C5H12O4/c1-8-5(3-6,4-7)9-2/h6-7H,3-4H2,1-2H3
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2，2-Dimethoxypropan-1-amineCas Number: 131713-50-3 Compound CID: 14900207Formula: C5H13NO2 Molecular Weight: 119.16IUPAC Name: 2,2-dimethoxypropan-1-amineSMILES: CC(CN)(OC)OCInChIKey: CJZOSFDKUBPWHD-UHFFFAOYSA-NInChI: InChI=1S/C5H13NO2/c1-5(4-6,7-2)8-3/h4,6H2,1-3H3
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2，2-Dimethyl-1，3-dioxan-5-olCas Number: 3391-30-8 Compound CID: 11029884Formula: C6H12O3 Molecular Weight: 132.16IUPAC Name: 2,2-dimethyl-1,3-dioxan-5-olSMILES: CC1(OCC(CO1)O)CInChIKey: CGNOMSJAJQUXAT-UHFFFAOYSA-NInChI: InChI=1S/C6H12O3/c1-6(2)8-3-5(7)4-9-6/h5,7H,3-4H2,1-2H3
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2，2-DIMETHYL-1，3-DIOXANE-5-CARBOXYLIC ACIDCas Number: 162635-09-8 Compound CID: 15223224Formula: C7H12O4 Molecular Weight: 160.17IUPAC Name: 2,2-dimethyl-1,3-dioxane-5-carboxylic acidSMILES: CC1(OCC(CO1)C(=O)O)CInChIKey: XUUUBCBLTSCBMO-UHFFFAOYSA-NInChI: InChI=1S/C7H12O4/c1-7(2)10-3-5(4-11-7)6(8)9/h5H,3-4H2,1-2H3,(H,8,9)
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2-(3-Chloropropyl)-2,5,5-trimethyl-1,3-dioxaneCas Number: 88128-57-8 Compound CID: 13199890Formula: C10H19ClO2 Molecular Weight: 206.71IUPAC Name: 2-(3-chloropropyl)-2,5,5-trimethyl-1,3-dioxaneSMILES: CC1(COC(OC1)(C)CCCCl)CInChIKey: LESDKFYPLUGGMG-UHFFFAOYSA-NInChI: InChI=1S/C10H19ClO2/c1-9(2)7-12-10(3,13-8-9)5-4-6-11/h4-8H2,1-3H3
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1，4-DIOXASPIRO[4.5]DECANE-8-ACETONITRILECas Number: 124499-37-2 Compound CID: 10241426Formula: C10H15NO2 Molecular Weight: 181.23IUPAC Name: 2-(1,4-dioxaspiro[4.5]decan-8-yl)acetonitrileSMILES: C1CC2(CCC1CC#N)OCCO2InChIKey: BLIRGGYUBXDIHJ-UHFFFAOYSA-NInChI: InChI=1S/C10H15NO2/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h9H,1-5,7-8H2
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1，4-Dioxaspiro[4，5]dec-7-en-8-boronic acidCas Number: 850567-90-7 Compound CID: 44118765Formula: C8H13BO4 Molecular Weight: 184IUPAC Name: 1,4-dioxaspiro[4.5]dec-7-en-8-ylboronic acidSMILES: B(C1=CCC2(CC1)OCCO2)(O)OInChIKey: WDXCZWJQOFPQOS-UHFFFAOYSA-NInChI: InChI=1S/C8H13BO4/c10-9(11)7-1-3-8(4-2-7)12-5-6-13-8/h1,10-11H,2-6H2
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1，4-DIOXASPIRO[4.5]DECANE-8-ACETIC ACIDCas Number: 134136-04-2 Compound CID: 15101121Formula: C10H16O4 Molecular Weight: 200.23IUPAC Name: 2-(1,4-dioxaspiro[4.5]decan-8-yl)acetic acidSMILES: C1CC2(CCC1CC(=O)O)OCCO2InChIKey: RDZCSTLPRXANJV-UHFFFAOYSA-NInChI: InChI=1S/C10H16O4/c11-9(12)7-8-1-3-10(4-2-8)13-5-6-14-10/h8H,1-7H2,(H,11,12)
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1，4-DIOXASPIRO[4.5]DEC-8-YLIDENEACETONITRILECas Number: 124499-35-0 Compound CID: 22624677Formula: C10H13NO2 Molecular Weight: 179.21IUPAC Name: 2-(1,4-dioxaspiro[4.5]decan-8-ylidene)acetonitrileSMILES: C1CC2(CCC1=CC#N)OCCO2InChIKey: IGDLFUWXBQNWJP-UHFFFAOYSA-NInChI: InChI=1S/C10H13NO2/c11-6-3-9-1-4-10(5-2-9)12-7-8-13-10/h3H,1-2,4-5,7-8H2
