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Phthalic acid, 2-ethoxyethyl pentadecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-ethoxyethyl pentadecyl ester
SpectraBase Compound ID 68NApsvjgFm
InChI InChI=1S/C27H44O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-18-21-31-26(28)24-19-16-17-20-25(24)27(29)32-23-22-30-4-2/h16-17,19-20H,3-15,18,21-23H2,1-2H3
InChIKey RWMJDOAAPRPCAQ-UHFFFAOYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C27H44O5
Exact Mass 448.318875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 73EqaC6cGQV
Name Phthalic acid, 2-ethoxyethyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 448.318874512 u
Formula C27H44O5
InChI InChI=1S/C27H44O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-18-21-31-26(28)24-19-16-17-20-25(24)27(29)32-23-22-30-4-2/h16-17,19-20H,3-15,18,21-23H2,1-2H3
InChIKey RWMJDOAAPRPCAQ-UHFFFAOYSA-N
Molecular Weight 448.644 g/mol
SMILES C1(=C(C=CC=C1)C(=O)OCCOCC)C(OCCCCCCCCCCCCCCC)=O