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Phthalic acid, 6-methylhept-2-yl tetradecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Phthalic acid, 6-methylhept-2-yl tetradecyl ester
SpectraBase Compound ID 1I8RkZ1FXAj
InChI InChI=1S/C30H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-18-24-33-29(31)27-22-16-17-23-28(27)30(32)34-26(4)21-19-20-25(2)3/h16-17,22-23,25-26H,5-15,18-21,24H2,1-4H3
InChIKey HELDDLOJYXLVRY-UHFFFAOYSA-N
Mol Weight 474.7 g/mol
Molecular Formula C30H50O4
Exact Mass 474.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D8xNN2mwbzP
Name Phthalic acid, 6-methylhept-2-yl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 474.370910086 u
Formula C30H50O4
InChI InChI=1S/C30H50O4/c1-5-6-7-8-9-10-11-12-13-14-15-18-24-33-29(31)27-22-16-17-23-28(27)30(32)34-26(4)21-19-20-25(2)3/h16-17,22-23,25-26H,5-15,18-21,24H2,1-4H3
InChIKey HELDDLOJYXLVRY-UHFFFAOYSA-N
Molecular Weight 474.726 g/mol
SMILES C(C1=CC=CC=C1C(OC(C)CCCC(C)C)=O)(OCCCCCCCCCCCCCC)=O