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Octadecyl 4-methylbenzoate

View entire compound with spectra: 1 MS (GC)

Octadecyl 4-methylbenzoate
SpectraBase Compound ID 96m9TeaAmXR
InChI InChI=1S/C26H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-26(27)25-21-19-24(2)20-22-25/h19-22H,3-18,23H2,1-2H3
InChIKey VFDQXUGAATXMBU-UHFFFAOYSA-N
Mol Weight 388.6 g/mol
Molecular Formula C26H44O2
Exact Mass 388.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwL1Pgsv8jA
Name Octadecyl 4-methylbenzoate
Alternate Name(s) p-Toluic acid, octadecyl ester p-Toluylic acid, octadecyl ester 4-Methylbenzoic acid octadecyl ester
CAS Registry Number 75260-42-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H44O2
InChI InChI=1S/C26H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-28-26(27)25-21-19-24(2)20-22-25/h19-22H,3-18,23H2,1-2H3
InChIKey VFDQXUGAATXMBU-UHFFFAOYSA-N
Molecular Weight 388.636 g/mol
SMILES C(=O)(OCCCCCCCCCCCCCCCCCC)c1ccc(C)cc1
SPLASH splash10-000i-3900000000-e5851f475f28594c8b6a
Source of Spectrum NP-14-1630-0
Wiley ID 1111566