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Cyclopropanecarboxylic acid, trans-2-phenyl-, tridec-5-yl ester

View entire compound with spectra: 1 NMR

Cyclopropanecarboxylic acid, trans-2-phenyl-, tridec-5-yl ester
SpectraBase Compound ID lqj5t0hVji
InChI InChI=1S/C23H36O2/c1-3-5-7-8-9-13-17-20(16-6-4-2)25-23(24)22-18-21(22)19-14-11-10-12-15-19/h10-12,14-15,20-22H,3-9,13,16-18H2,1-2H3
InChIKey RVRSOFDORKXKFK-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C23H36O2
Exact Mass 344.27153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D3DXQ33p4LL
Name Cyclopropanecarboxylic acid, trans-2-phenyl-, tridec-5-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 344.271530397 u
Formula C23H36O2
InChI InChI=1S/C23H36O2/c1-3-5-7-8-9-13-17-20(16-6-4-2)25-23(24)22-18-21(22)19-14-11-10-12-15-19/h10-12,14-15,20-22H,3-9,13,16-18H2,1-2H3
InChIKey RVRSOFDORKXKFK-UHFFFAOYSA-N
Molecular Weight 344.539 g/mol
SMILES C1C(C2=CC=CC=C2)C1C(OC(CCCCCCCC)CCCC)=O