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Phthalic acid, decyl 2-methylbenzyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, decyl 2-methylbenzyl ester
SpectraBase Compound ID CnEToxtZI1Q
InChI InChI=1S/C26H34O4/c1-3-4-5-6-7-8-9-14-19-29-25(27)23-17-12-13-18-24(23)26(28)30-20-22-16-11-10-15-21(22)2/h10-13,15-18H,3-9,14,19-20H2,1-2H3
InChIKey ZXPJJUNJZKSAOP-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 F4D15MQyfVz
Name Phthalic acid, decyl 2-methylbenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 410.245709571 u
Formula C26H34O4
InChI InChI=1S/C26H34O4/c1-3-4-5-6-7-8-9-14-19-29-25(27)23-17-12-13-18-24(23)26(28)30-20-22-16-11-10-15-21(22)2/h10-13,15-18H,3-9,14,19-20H2,1-2H3
InChIKey ZXPJJUNJZKSAOP-UHFFFAOYSA-N
Molecular Weight 410.554 g/mol
SMILES C1=CC(=C(C=C1)C(=O)OCC1=CC=CC=C1C)C(=O)OCCCCCCCCCC