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Glutaric acid, hexadecyl 2-isopropylphenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, hexadecyl 2-isopropylphenyl ester
SpectraBase Compound ID Fic0w3RaqFs
InChI InChI=1S/C30H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-33-29(31)23-20-24-30(32)34-28-22-18-17-21-27(28)26(2)3/h17-18,21-22,26H,4-16,19-20,23-25H2,1-3H3
InChIKey MWPZMXSLHKHNDF-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 7uZTh5H4H6G
Name Glutaric acid, hexadecyl 2-isopropylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.370910086 u
Formula C30H50O4
InChI InChI=1S/C30H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25-33-29(31)23-20-24-30(32)34-28-22-18-17-21-27(28)26(2)3/h17-18,21-22,26H,4-16,19-20,23-25H2,1-3H3
InChIKey MWPZMXSLHKHNDF-UHFFFAOYSA-N
Molecular Weight 474.726 g/mol
SMILES CCCCCCCCCCCCCCCCOC(CCCC(OC1=CC=CC=C1C(C)C)=O)=O