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4-(4-tert-Butyl-phenyl)-6-ethoxy-chromen-2-one
SpectraBase Compound ID z6Nwx1pipk
InChI InChI=1S/C21H22O3/c1-5-23-16-10-11-19-18(12-16)17(13-20(22)24-19)14-6-8-15(9-7-14)21(2,3)4/h6-13H,5H2,1-4H3
InChIKey AQRDHTOVMVKZEM-UHFFFAOYSA-N
Mol Weight 322.4 g/mol
Molecular Formula C21H22O3
Exact Mass 322.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3cbpZVVeEa
Name 4-(4-tert-Butyl-phenyl)-6-ethoxy-chromen-2-one
Alternate Name(s) 6-Ethoxy-4-(4-tert-butylphenyl)coumarin 4-(4-tert-butylphenyl)-6-ethoxy-1-benzopyran-2-one 4-(4-tert-butylphenyl)-6-ethoxychromen-2-one 4-(4-tert-butylphenyl)-6-ethoxy-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O3
InChI InChI=1S/C21H22O3/c1-5-23-16-10-11-19-18(12-16)17(13-20(22)24-19)14-6-8-15(9-7-14)21(2,3)4/h6-13H,5H2,1-4H3
InChIKey AQRDHTOVMVKZEM-UHFFFAOYSA-N
Molecular Weight 322.404 g/mol
SMILES C=1(c2c(ccc(c2)OCC)OC(C1)=O)c1ccc(C(C)(C)C)cc1
SPLASH splash10-00di-0029000000-540072f43ff6eea8d994
Source of Spectrum U1-2010-4134-6h
Wiley ID 1664157