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Phthalic acid, 5-methoxy-3-methylpent-2-yl nonyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 5-methoxy-3-methylpent-2-yl nonyl ester
SpectraBase Compound ID IoaZuZ4nk7A
InChI InChI=1S/C24H38O5/c1-5-6-7-8-9-10-13-17-28-23(25)21-14-11-12-15-22(21)24(26)29-20(3)19(2)16-18-27-4/h11-12,14-15,19-20H,5-10,13,16-18H2,1-4H3
InChIKey VICWENBHVJZBEF-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C24H38O5
Exact Mass 406.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrqNkAcu2sV
Name Phthalic acid, 5-methoxy-3-methylpent-2-yl nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 406.271924319 u
Formula C24H38O5
InChI InChI=1S/C24H38O5/c1-5-6-7-8-9-10-13-17-28-23(25)21-14-11-12-15-22(21)24(26)29-20(3)19(2)16-18-27-4/h11-12,14-15,19-20H,5-10,13,16-18H2,1-4H3
InChIKey VICWENBHVJZBEF-UHFFFAOYSA-N
Molecular Weight 406.563 g/mol
SMILES C(C1=C(C=CC=C1)C(OC(C(CCOC)C)C)=O)(OCCCCCCCCC)=O