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Glutaric acid, 1-(cyclohex-2-enyl)hex-3-yl cyclohexylmethyl ester

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

Glutaric acid, 1-(cyclohex-2-enyl)hex-3-yl cyclohexylmethyl ester
SpectraBase Compound ID B5pb64srrTl
InChI InChI=1S/C24H40O4/c1-2-10-22(18-17-20-11-5-3-6-12-20)28-24(26)16-9-15-23(25)27-19-21-13-7-4-8-14-21/h5,11,20-22H,2-4,6-10,12-19H2,1H3
InChIKey GUDZARSKLUBCKR-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C24H40O4
Exact Mass 392.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAmqivnmdUv
Name Glutaric acid, 1-(cyclohex-2-enyl)hex-3-yl cyclohexylmethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 392.292659764 u
Formula C24H40O4
InChI InChI=1S/C24H40O4/c1-2-10-22(18-17-20-11-5-3-6-12-20)28-24(26)16-9-15-23(25)27-19-21-13-7-4-8-14-21/h5,11,20-22H,2-4,6-10,12-19H2,1H3
InChIKey GUDZARSKLUBCKR-UHFFFAOYSA-N
Molecular Weight 392.580 g/mol
SMILES C(CCC(OCC1CCCCC1)=O)C(OC(CCC)CCC1C=CCCC1)=O