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Succinic acid, 4-chloro-3-methylphenyl non-3-en-1-yl ester

View entire compound with spectra: 1 NMR

Succinic acid, 4-chloro-3-methylphenyl non-3-en-1-yl ester
SpectraBase Compound ID 1GchDPwUH7j
InChI InChI=1S/C20H27ClO4/c1-3-4-5-6-7-8-9-14-24-19(22)12-13-20(23)25-17-10-11-18(21)16(2)15-17/h7-8,10-11,15H,3-6,9,12-14H2,1-2H3/b8-7+
InChIKey IANBKEXRTISLMI-BQYQJAHWSA-N
Mol Weight 366.89 g/mol
Molecular Formula C20H27ClO4
Exact Mass 366.159787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID cmjL52sIyQ
Name Succinic acid, 4-chloro-3-methylphenyl non-3-en-1-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 366.159787045 u
Formula C20H27ClO4
InChI InChI=1S/C20H27ClO4/c1-3-4-5-6-7-8-9-14-24-19(22)12-13-20(23)25-17-10-11-18(21)16(2)15-17/h7-8,10-11,15H,3-6,9,12-14H2,1-2H3/b8-7+
InChIKey IANBKEXRTISLMI-BQYQJAHWSA-N
Molecular Weight 366.885 g/mol
SMILES C(CC(OC1=CC(C)=C(C=C1)Cl)=O)C(OCC\C=C\CCCCC)=O