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Glutaric acid, 3-chlorophenyl neryl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Glutaric acid, 3-chlorophenyl neryl ester
SpectraBase Compound ID HuxW2H7KUU
InChI InChI=1S/C21H27ClO4/c1-16(2)7-4-8-17(3)13-14-25-20(23)11-6-12-21(24)26-19-10-5-9-18(22)15-19/h5,7,9-10,13,15H,4,6,8,11-12,14H2,1-3H3/b17-13-
InChIKey HWTHFXFJZAAXEE-LGMDPLHJSA-N
Mol Weight 378.9 g/mol
Molecular Formula C21H27ClO4
Exact Mass 378.159787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FIox725l7Pg
Name Glutaric acid, 3-chlorophenyl neryl ester
Comments Computed using HOSE algorithm
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Exact Mass 378.159787045 u
Formula C21H27ClO4
InChI InChI=1S/C21H27ClO4/c1-16(2)7-4-8-17(3)13-14-25-20(23)11-6-12-21(24)26-19-10-5-9-18(22)15-19/h5,7,9-10,13,15H,4,6,8,11-12,14H2,1-3H3/b17-13-
InChIKey HWTHFXFJZAAXEE-LGMDPLHJSA-N
Molecular Weight 378.896 g/mol
SMILES C(CCC(OC1=CC(=CC=C1)Cl)=O)C(OC\C=C\(C)CCC=C(C)C)=O