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Ethyl 4-cyano-3-(1,1-dimethylethyl)benzoate
SpectraBase Compound ID CDPcHBge1OS
InChI InChI=1S/C14H17NO2/c1-5-17-13(16)10-6-7-11(9-15)12(8-10)14(2,3)4/h6-8H,5H2,1-4H3
InChIKey LRWMQWUDGUQGBP-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IWcXuHllwab
Name Ethyl 4-cyano-3-(1,1-dimethylethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c1-5-17-13(16)10-6-7-11(9-15)12(8-10)14(2,3)4/h6-8H,5H2,1-4H3
InChIKey LRWMQWUDGUQGBP-UHFFFAOYSA-N
Molecular Weight 231.295 g/mol
SMILES c1(cc(C(=O)OCC)ccc1C#N)C(C)(C)C
SPLASH splash10-014i-0290000000-535a7b23b365038be15d
Source of Spectrum C-119-8800-13
Synonyms Ethyl 3-tert-butyl-4-cyanobenzoate
Wiley ID 760598