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4-Ethoxyphenyl 4-heptylbenzoate

View entire compound with spectra: 1 MS (GC)

4-Ethoxyphenyl 4-heptylbenzoate
SpectraBase Compound ID ISAR4v9eYQ5
InChI InChI=1S/C22H28O3/c1-3-5-6-7-8-9-18-10-12-19(13-11-18)22(23)25-21-16-14-20(15-17-21)24-4-2/h10-17H,3-9H2,1-2H3
InChIKey JVYMIINWUABWEK-UHFFFAOYSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JldzRQiixo
Name 4-Ethoxyphenyl 4-heptylbenzoate
Alternate Name(s) 4-Heptylbenzoic acid (4-ethoxyphenyl) ester 4-Heptylbenzoic acid p-phenetyl ester
CAS Registry Number 302601-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-3-5-6-7-8-9-18-10-12-19(13-11-18)22(23)25-21-16-14-20(15-17-21)24-4-2/h10-17H,3-9H2,1-2H3
InChIKey JVYMIINWUABWEK-UHFFFAOYSA-N
Molecular Weight 340.463 g/mol
SMILES c1(OC(c2ccc(CCCCCCC)cc2)=O)ccc(OCC)cc1
SPLASH splash10-0udi-4290000000-a4919da4343d56c80c46
Wiley ID 1458076