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Succinic acid, dodecyl 4-tert-butylphenyl ester

View entire compound with spectra: 1 NMR

Succinic acid, dodecyl 4-tert-butylphenyl ester
SpectraBase Compound ID LYSHiblaQzn
InChI InChI=1S/C26H42O4/c1-5-6-7-8-9-10-11-12-13-14-21-29-24(27)19-20-25(28)30-23-17-15-22(16-18-23)26(2,3)4/h15-18H,5-14,19-21H2,1-4H3
InChIKey BRFQUPRDVQTTOU-UHFFFAOYSA-N
Mol Weight 418.6 g/mol
Molecular Formula C26H42O4
Exact Mass 418.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JKI3AfGyj2G
Name Succinic acid, dodecyl 4-tert-butylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.308309828 u
Formula C26H42O4
InChI InChI=1S/C26H42O4/c1-5-6-7-8-9-10-11-12-13-14-21-29-24(27)19-20-25(28)30-23-17-15-22(16-18-23)26(2,3)4/h15-18H,5-14,19-21H2,1-4H3
InChIKey BRFQUPRDVQTTOU-UHFFFAOYSA-N
Molecular Weight 418.618 g/mol
SMILES C(CCC(OC1=CC=C(C=C1)C(C)(C)C)=O)(OCCCCCCCCCCCC)=O