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Glutaric acid, 2-isopropylphenyl tetradecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-isopropylphenyl tetradecyl ester
SpectraBase Compound ID BumUZyiMJuB
InChI InChI=1S/C28H46O4/c1-4-5-6-7-8-9-10-11-12-13-14-17-23-31-27(29)21-18-22-28(30)32-26-20-16-15-19-25(26)24(2)3/h15-16,19-20,24H,4-14,17-18,21-23H2,1-3H3
InChIKey OJRVCSBTSYTWJB-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C28H46O4
Exact Mass 446.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7VKSsm24XfR
Name Glutaric acid, 2-isopropylphenyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 446.339609957 u
Formula C28H46O4
InChI InChI=1S/C28H46O4/c1-4-5-6-7-8-9-10-11-12-13-14-17-23-31-27(29)21-18-22-28(30)32-26-20-16-15-19-25(26)24(2)3/h15-16,19-20,24H,4-14,17-18,21-23H2,1-3H3
InChIKey OJRVCSBTSYTWJB-UHFFFAOYSA-N
Molecular Weight 446.672 g/mol
SMILES CCCCCCCCCCCCCCOC(CCCC(OC1=CC=CC=C1C(C)C)=O)=O