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Butyl 3,4-dimethylbenzoate
SpectraBase Compound ID 9YlvhC9N7d1
InChI InChI=1S/C13H18O2/c1-4-5-8-15-13(14)12-7-6-10(2)11(3)9-12/h6-7,9H,4-5,8H2,1-3H3
InChIKey BWZNCIFOYGRWMO-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nydOF7N4q
Name Butyl 3,4-dimethylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-4-5-8-15-13(14)12-7-6-10(2)11(3)9-12/h6-7,9H,4-5,8H2,1-3H3
InChIKey BWZNCIFOYGRWMO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000047
Molecular Weight 206.285 g/mol
SMILES C(c1cc(c(cc1)C)C)(=O)OCCCC
SPLASH splash10-0ue9-0900000000-21ff5530ba659d6c20c3
Source of Spectrum ASC-352-1208-1208_1
Synonyms Benzoic acid, 3,4-dimethyl-, n-butyl ester
Wiley ID 1764458