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Glutaric acid, cyclohexylmethyl 2-naphthyl ester
SpectraBase Compound ID LvqXaxRP7vs
InChI InChI=1S/C22H26O4/c23-21(25-16-17-7-2-1-3-8-17)11-6-12-22(24)26-20-14-13-18-9-4-5-10-19(18)15-20/h4-5,9-10,13-15,17H,1-3,6-8,11-12,16H2
InChIKey UCSCBTSKLOMIEV-UHFFFAOYSA-N
Mol Weight 354.45 g/mol
Molecular Formula C22H26O4
Exact Mass 354.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CvRcmGyjJnC
Name Glutaric acid, cyclohexylmethyl 2-naphthyl ester
Comments Computed using HOSE algorithm
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Exact Mass 354.183109313 u
Formula C22H26O4
InChI InChI=1S/C22H26O4/c23-21(25-16-17-7-2-1-3-8-17)11-6-12-22(24)26-20-14-13-18-9-4-5-10-19(18)15-20/h4-5,9-10,13-15,17H,1-3,6-8,11-12,16H2
InChIKey UCSCBTSKLOMIEV-UHFFFAOYSA-N
Molecular Weight 354.446 g/mol
SMILES C(CCC(OCC1CCCCC1)=O)C(OC=1C=CC2=CC=CC=C2C1)=O