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Phthalic acid, dodecyl phenyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, dodecyl phenyl ester
SpectraBase Compound ID 5azt8OGsOrx
InChI InChI=1S/C26H34O4/c1-2-3-4-5-6-7-8-9-10-16-21-29-25(27)23-19-14-15-20-24(23)26(28)30-22-17-12-11-13-18-22/h11-15,17-20H,2-10,16,21H2,1H3
InChIKey BOQBSCSKJLORJM-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C26H34O4
Exact Mass 410.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjlK40QdhuJ
Name Phthalic acid, dodecyl phenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 410.245709571 u
Formula C26H34O4
InChI InChI=1S/C26H34O4/c1-2-3-4-5-6-7-8-9-10-16-21-29-25(27)23-19-14-15-20-24(23)26(28)30-22-17-12-11-13-18-22/h11-15,17-20H,2-10,16,21H2,1H3
InChIKey BOQBSCSKJLORJM-UHFFFAOYSA-N
Molecular Weight 410.554 g/mol
SMILES C1(=CC=CC=C1)OC(C1=C(C=CC=C1)C(=O)OCCCCCCCCCCCC)=O