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Pentanoic acid, 1,3,3-trimethylbicyclo[2.2.1]hept-2-yl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Pentanoic acid, 1,3,3-trimethylbicyclo[2.2.1]hept-2-yl ester
SpectraBase Compound ID J4AjryEMa1W
InChI InChI=1S/C15H26O2/c1-5-6-7-12(16)17-13-14(2,3)11-8-9-15(13,4)10-11/h11,13H,5-10H2,1-4H3/t11-,13-,15+/m1/s1
InChIKey ZNDQBRJIQWIGOF-KYOSRNDESA-N
Mol Weight 238.37 g/mol
Molecular Formula C15H26O2
Exact Mass 238.19328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C9JRc1Mh35Q
Name Pentanoic acid, 1,3,3-trimethylbicyclo[2.2.1]hept-2-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 238.193280075 u
Formula C15H26O2
InChI InChI=1S/C15H26O2/c1-5-6-7-12(16)17-13-14(2,3)11-8-9-15(13,4)10-11/h11,13H,5-10H2,1-4H3/t11-,13-,15+/m1/s1
InChIKey ZNDQBRJIQWIGOF-KYOSRNDESA-N
Molecular Weight 238.371 g/mol
SMILES [C@]12(C)[C@](OC(CCCC)=O)(C(C)(C)[C@@](C2)(CC1)[H])[H]