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Hexyl 4-ethylbenzoate
SpectraBase Compound ID Divp1Bhw8H6
InChI InChI=1S/C15H22O2/c1-3-5-6-7-12-17-15(16)14-10-8-13(4-2)9-11-14/h8-11H,3-7,12H2,1-2H3
InChIKey WWCOVCJCTORFJV-UHFFFAOYSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFBTuQmg9nE
Name Hexyl 4-ethylbenzoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 234.161979946 u
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-3-5-6-7-12-17-15(16)14-10-8-13(4-2)9-11-14/h8-11H,3-7,12H2,1-2H3
InChIKey WWCOVCJCTORFJV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 234.339 g/mol
Nominal Mass 234 u
Quality 956
Retention Index 1772
SMILES C=1(C(OCCCCCC)=O)C=CC(=CC1)CC
SPLASH splash10-0udi-3900000000-04fffe0696b77496b467
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Ethylbenzoic acid hexyl ester
Technique GC/MS
Wiley ID DD2024_022419