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Phthalic acid, nonyl trans-hex-3-enyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, nonyl trans-hex-3-enyl ester
SpectraBase Compound ID 6DWcbkQmGVZ
InChI InChI=1S/C23H34O4/c1-3-5-7-9-10-11-15-19-27-23(25)21-17-13-12-16-20(21)22(24)26-18-14-8-6-4-2/h6,8,12-13,16-17H,3-5,7,9-11,14-15,18-19H2,1-2H3/b8-6+
InChIKey ZHOVZTKLWDLLDM-SOFGYWHQSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BhoSCo5VAp6
Name Phthalic acid, nonyl trans-hex-3-enyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 374.245709571 u
Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-3-5-7-9-10-11-15-19-27-23(25)21-17-13-12-16-20(21)22(24)26-18-14-8-6-4-2/h6,8,12-13,16-17H,3-5,7,9-11,14-15,18-19H2,1-2H3/b8-6+
InChIKey ZHOVZTKLWDLLDM-SOFGYWHQSA-N
Molecular Weight 374.521 g/mol
SMILES C1(=CC=CC=C1C(OCCCCCCCCC)=O)C(OCC\C=C\CC)=O