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Glutaric acid, (2-methylcyclohex-1-enyl)methyl 3-chlorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, (2-methylcyclohex-1-enyl)methyl 3-chlorophenyl ester
SpectraBase Compound ID BD16ysqtQqM
InChI InChI=1S/C19H23ClO4/c1-14-6-2-3-7-15(14)13-23-18(21)10-5-11-19(22)24-17-9-4-8-16(20)12-17/h4,8-9,12H,2-3,5-7,10-11,13H2,1H3
InChIKey DUHISALIWPYBBN-UHFFFAOYSA-N
Mol Weight 350.84 g/mol
Molecular Formula C19H23ClO4
Exact Mass 350.128487 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KK87ghI5KOC
Name Glutaric acid, (2-methylcyclohex-1-enyl)methyl 3-chlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 350.128486917 u
Formula C19H23ClO4
InChI InChI=1S/C19H23ClO4/c1-14-6-2-3-7-15(14)13-23-18(21)10-5-11-19(22)24-17-9-4-8-16(20)12-17/h4,8-9,12H,2-3,5-7,10-11,13H2,1H3
InChIKey DUHISALIWPYBBN-UHFFFAOYSA-N
Molecular Weight 350.842 g/mol
SMILES C(CCC(OC1=CC(=CC=C1)Cl)=O)C(OCC1=C(C)CCCC1)=O