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Succinic acid, naphth-2-ylmethyl cis-4-methylcyclohexyl ester
SpectraBase Compound ID IrkBFJ99hHy
InChI InChI=1S/C22H26O4/c1-16-6-10-20(11-7-16)26-22(24)13-12-21(23)25-15-17-8-9-18-4-2-3-5-19(18)14-17/h2-5,8-9,14,16,20H,6-7,10-13,15H2,1H3
InChIKey JGSCGESOTFPLKS-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 CgnqAQ376oW
Name Succinic acid, naphth-2-ylmethyl cis-4-methylcyclohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 354.183109313 u
Formula C22H26O4
InChI InChI=1S/C22H26O4/c1-16-6-10-20(11-7-16)26-22(24)13-12-21(23)25-15-17-8-9-18-4-2-3-5-19(18)14-17/h2-5,8-9,14,16,20H,6-7,10-13,15H2,1H3
InChIKey JGSCGESOTFPLKS-UHFFFAOYSA-N
Molecular Weight 354.446 g/mol
SMILES C(CC(OCC1=CC2=C(C=CC=C2)C=C1)=O)C(OC1CCC(C)CC1)=O