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Cyclopropanecarboxylic acid, trans-2-phenyl-, pentadec-4-yl ester
SpectraBase Compound ID 9XLl7Jj1HFS
InChI InChI=1S/C25H40O2/c1-3-5-6-7-8-9-10-11-15-19-22(16-4-2)27-25(26)24-20-23(24)21-17-13-12-14-18-21/h12-14,17-18,22-24H,3-11,15-16,19-20H2,1-2H3
InChIKey WHUGPZKFSKVDQF-UHFFFAOYSA-N
Mol Weight 372.6 g/mol
Molecular Formula C25H40O2
Exact Mass 372.302831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID cUTEfNgVbV
Name Cyclopropanecarboxylic acid, trans-2-phenyl-, pentadec-4-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 372.302830526 u
Formula C25H40O2
InChI InChI=1S/C25H40O2/c1-3-5-6-7-8-9-10-11-15-19-22(16-4-2)27-25(26)24-20-23(24)21-17-13-12-14-18-21/h12-14,17-18,22-24H,3-11,15-16,19-20H2,1-2H3
InChIKey WHUGPZKFSKVDQF-UHFFFAOYSA-N
Molecular Weight 372.593 g/mol
SMILES C1C(C2=CC=CC=C2)C1C(OC(CCCCCCCCCCC)CCC)=O