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7-Methoxy-8-(2'-trifluoroacetoxy-3'-hydroxy-3'-methylbutyl)coumarin
SpectraBase Compound ID 4QN16iFUCm6
InChI InChI=1S/C17H17F3O6/c1-16(2,23)12(25-15(22)17(18,19)20)8-10-11(24-3)6-4-9-5-7-13(21)26-14(9)10/h4-7,12,23H,8H2,1-3H3
InChIKey DODPFATWHIKMGO-UHFFFAOYSA-N
Mol Weight 374.31 g/mol
Molecular Formula C17H17F3O6
Exact Mass 374.097723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 16geeNfNL59
Name 7-Methoxy-8-(2'-trifluoroacetoxy-3'-hydroxy-3'-methylbutyl)coumarin
Alternate Name(s) 2-Hydroxy-1-[(7-methoxy-2-oxo-2H-chromen-8-yl)methyl]-2-methylpropyl trifluoroacetate
CAS Registry Number 93525-01-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17F3O6
InChI InChI=1S/C17H17F3O6/c1-16(2,23)12(25-15(22)17(18,19)20)8-10-11(24-3)6-4-9-5-7-13(21)26-14(9)10/h4-7,12,23H,8H2,1-3H3
InChIKey DODPFATWHIKMGO-UHFFFAOYSA-N
Molecular Weight 374.312 g/mol
SMILES OC(C(OC(C(F)(F)F)=O)Cc1c2OC(=O)C=Cc2ccc1OC)(C)C
SPLASH splash10-00ll-0930000000-88bc3694112243068aed
Source of Spectrum W5-1989-35045-30491
Wiley ID 1356422