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3-Octoxyphenyl benzoate

View entire compound with spectra: 1 MS (GC)

3-Octoxyphenyl benzoate
SpectraBase Compound ID 6G72jXAK0HG
InChI InChI=1S/C21H26O3/c1-2-3-4-5-6-10-16-23-19-14-11-15-20(17-19)24-21(22)18-12-8-7-9-13-18/h7-9,11-15,17H,2-6,10,16H2,1H3
InChIKey WECVSUOAVQMNIF-UHFFFAOYSA-N
Mol Weight 326.44 g/mol
Molecular Formula C21H26O3
Exact Mass 326.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gtqjsa6WazJ
Name 3-Octoxyphenyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O3
InChI InChI=1S/C21H26O3/c1-2-3-4-5-6-10-16-23-19-14-11-15-20(17-19)24-21(22)18-12-8-7-9-13-18/h7-9,11-15,17H,2-6,10,16H2,1H3
InChIKey WECVSUOAVQMNIF-UHFFFAOYSA-N
Molecular Weight 326.436 g/mol
SMILES C(Oc1cc(OCCCCCCCC)ccc1)(=O)c1ccccc1
SPLASH splash10-0a4i-3900000000-544151f5d249666961e5
Source of Spectrum IC-940-0-0
Synonyms 3-(octyloxy)phenyl benzoate
Wiley ID 1325096