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Penbutolol 2AC
SpectraBase Compound ID 4bVcUQPvW6t
InChI InChI=1S/C22H33NO4/c1-16(24)23(22(3,4)5)14-19(27-17(2)25)15-26-21-13-9-8-12-20(21)18-10-6-7-11-18/h8-9,12-13,18-19H,6-7,10-11,14-15H2,1-5H3
InChIKey PSAZFLFWDPVWMY-UHFFFAOYSA-N
Mol Weight 375.5 g/mol
Molecular Formula C22H33NO4
Exact Mass 375.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kb5GBQwVC8W
Name 2-Acetoxy-3-(2-cyclopentylphenoxy)propylamine, N-acetyl-N-tert butyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33NO4
InChI InChI=1S/C22H33NO4/c1-16(24)23(22(3,4)5)14-19(27-17(2)25)15-26-21-13-9-8-12-20(21)18-10-6-7-11-18/h8-9,12-13,18-19H,6-7,10-11,14-15H2,1-5H3
InChIKey PSAZFLFWDPVWMY-UHFFFAOYSA-N
Molecular Weight 375.509 g/mol
SMILES C(N(C(C)(C)C)CC(OC(=O)C)COc1c(C2CCCC2)cccc1)(=O)C
SPLASH splash10-0a4i-9220000000-83b256a0ed1e7df3a184
Source of Spectrum JC-382-160-59
Synonyms 2-[Acetyl(tert-butyl)amino]-1-[(2-cyclopentylphenoxy)methyl]ethyl acetate Acetic acid [1-[acetyl(tert-butyl)amino]-3-(2-cyclopentylphenoxy)propan-2-yl] ester [1-[acetyl(tert-butyl)amino]-3-(2-cyclopentylphenoxy)propan-2-yl] acetate [1-[[acetyl(tert-butyl)amino]methyl]-2-(2-cyclopentylphenoxy)ethyl] acetate [1-[tert-butyl(ethanoyl)amino]-3-(2-cyclopentylphenoxy)propan-2-yl] ethanoate
Wiley ID 1357269