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Methyl 4-hexylbenzoate
SpectraBase Compound ID 3euRyB3QJX1
InChI InChI=1S/C14H20O2/c1-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16-2/h8-11H,3-7H2,1-2H3
InChIKey RTTGTHPEVMEHEK-UHFFFAOYSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fi8eD0WBfW0
Name Methyl 4-hexylbenzoate
Alternate Name(s) 4-Hexylbenzoic acid methyl ester Benzoic acid, 4-hexyl-, methyl ester Methyl p-hexylbenzoate
CAS Registry Number 38409-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16-2/h8-11H,3-7H2,1-2H3
InChIKey RTTGTHPEVMEHEK-UHFFFAOYSA-N
Molecular Weight 220.312 g/mol
SMILES CCCCCCc1ccc(cc1)C(=O)OC
SPLASH splash10-0fdp-5910000000-7b5113e656e26e4c5077
Source of Spectrum W5-1989-12801-1
Wiley ID 1220169