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4-(1,3-dioxan-2-yl)-1-cyclohexanecarboxylic acid methyl ester
SpectraBase Compound ID 25HTAKEpkt0
InChI InChI=1S/C12H20O4/c1-14-11(13)9-3-5-10(6-4-9)12-15-7-2-8-16-12/h9-10,12H,2-8H2,1H3
InChIKey IUOHTVPPYSYOAG-UHFFFAOYSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXdzJHV46mj
Name 4-(1,3-dioxan-2-yl)-1-cyclohexanecarboxylic acid methyl ester
Alternate Name(s) 4-(1,3-dioxan-2-yl)cyclohexanecarboxylic acid methyl ester Methyl 4-(1,3-dioxan-2-yl)cyclohexane-1-carboxylate Methyl 4-(1,3-dioxan-2-yl)cyclohexanecarboxylate
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Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-14-11(13)9-3-5-10(6-4-9)12-15-7-2-8-16-12/h9-10,12H,2-8H2,1H3
InChIKey IUOHTVPPYSYOAG-UHFFFAOYSA-N
Molecular Weight 228.288 g/mol
SMILES C1(OCCCO1)C1CCC(CC1)C(=O)OC
SPLASH splash10-000i-9000000000-9b7008f4087fe1fcb736
Source of Spectrum OV-689-641-3
Wiley ID 1575779