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Phthalic acid, dec-2-yl isohexyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, dec-2-yl isohexyl ester
SpectraBase Compound ID 6LQ3GoATWSg
InChI InChI=1S/C24H38O4/c1-5-6-7-8-9-10-15-20(4)28-24(26)22-17-12-11-16-21(22)23(25)27-18-13-14-19(2)3/h11-12,16-17,19-20H,5-10,13-15,18H2,1-4H3
InChIKey RVOIKEFXHPDJET-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GVWm5oevgJU
Name Phthalic acid, dec-2-yl isohexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.277009700 u
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-5-6-7-8-9-10-15-20(4)28-24(26)22-17-12-11-16-21(22)23(25)27-18-13-14-19(2)3/h11-12,16-17,19-20H,5-10,13-15,18H2,1-4H3
InChIKey RVOIKEFXHPDJET-UHFFFAOYSA-N
Molecular Weight 390.564 g/mol
SMILES C1=CC(=C(C=C1)C(OCCCC(C)C)=O)C(OC(C)CCCCCCCC)=O