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Methyl 4-ethylbenzoate
SpectraBase Compound ID 37P9uGybHSa
InChI InChI=1S/C10H12O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h4-7H,3H2,1-2H3
InChIKey CAABRJFUDNBRJZ-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dnk0LBJN4RE
Name Methyl 4-ethylbenzoate
CAS Registry Number 7364-20-7
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 164.083729624 u
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-3-8-4-6-9(7-5-8)10(11)12-2/h4-7H,3H2,1-2H3
InChIKey CAABRJFUDNBRJZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 164.204 g/mol
Nominal Mass 164 u
Quality 1000
Retention Index 1289
SMILES C=1(C(OC)=O)C=CC(=CC1)CC
SPLASH splash10-001i-3900000000-dae02ae58b072d408584
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Ethylbenzoic acid methyl ester
Technique GC/MS
Wiley ID DD2024_030142