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(Trifluoroacetyl)penbutolol
SpectraBase Compound ID Ait4W2dTKWL
InChI InChI=1S/C20H28F3NO3/c1-19(2,3)24-12-15(27-18(25)20(21,22)23)13-26-17-11-7-6-10-16(17)14-8-4-5-9-14/h6-7,10-11,14-15,24H,4-5,8-9,12-13H2,1-3H3
InChIKey AGAZMBWJQZTEMM-UHFFFAOYSA-N
Mol Weight 387.44 g/mol
Molecular Formula C20H28F3NO3
Exact Mass 387.202128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5w0PvMnDXpo
Name (Trifluoroacetyl)penbutolol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28F3NO3
InChI InChI=1S/C20H28F3NO3/c1-19(2,3)24-12-15(27-18(25)20(21,22)23)13-26-17-11-7-6-10-16(17)14-8-4-5-9-14/h6-7,10-11,14-15,24H,4-5,8-9,12-13H2,1-3H3
InChIKey AGAZMBWJQZTEMM-UHFFFAOYSA-N
Molecular Weight 387.443 g/mol
SMILES N(CC(OC(C(F)(F)F)=O)COc1c(C2CCCC2)cccc1)C(C)(C)C
SPLASH splash10-014i-0191000000-495ba04398ac50d8e3a3
Source of Spectrum JC-488-364-0
Synonyms 2-(tert-butylamino)-1-[(2-cyclopentylphenoxy)methyl]ethyl trifluoroacetate
Wiley ID 1363377