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Cyclopropanecarboxylic acid, 2-(1-adamantyl)ethyl ester

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Cyclopropanecarboxylic acid, 2-(1-adamantyl)ethyl ester
SpectraBase Compound ID GFAmXDR2vM1
InChI InChI=1S/C16H24O2/c17-15(14-1-2-14)18-4-3-16-8-11-5-12(9-16)7-13(6-11)10-16/h11-14H,1-10H2/t11-,12+,13-,16+
InChIKey OASTZEOCDBSCLC-HUZYZPTCSA-N
Mol Weight 248.37 g/mol
Molecular Formula C16H24O2
Exact Mass 248.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1arwlfQTqcP
Name Cyclopropanecarboxylic acid, 2-(1-adamantyl)ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 248.177630011 u
Formula C16H24O2
InChI InChI=1S/C16H24O2/c17-15(14-1-2-14)18-4-3-16-8-11-5-12(9-16)7-13(6-11)10-16/h11-14H,1-10H2/t11-,12+,13-,16+
InChIKey OASTZEOCDBSCLC-HUZYZPTCSA-N
Molecular Weight 248.366 g/mol
SMILES [C@]12(CC3(C[C@](C2)(C[C@](C1)(C3)[H])[H])CCOC(C1CC1)=O)[H]