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Penbutolol AC
SpectraBase Compound ID 7DmZi5ImSPR
InChI InChI=1S/C20H31NO3/c1-15(22)24-17(13-21-20(2,3)4)14-23-19-12-8-7-11-18(19)16-9-5-6-10-16/h7-8,11-12,16-17,21H,5-6,9-10,13-14H2,1-4H3
InChIKey ZLXHWBCBKJXERD-UHFFFAOYSA-N
Mol Weight 333.47 g/mol
Molecular Formula C20H31NO3
Exact Mass 333.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1ObBPaI2TY
Name 1-(2-cyclopentylphenyloxy)-2-acetoxy-3-(tert-butylamino)propane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31NO3
InChI InChI=1S/C20H31NO3/c1-15(22)24-17(13-21-20(2,3)4)14-23-19-12-8-7-11-18(19)16-9-5-6-10-16/h7-8,11-12,16-17,21H,5-6,9-10,13-14H2,1-4H3
InChIKey ZLXHWBCBKJXERD-UHFFFAOYSA-N
Molecular Weight 333.472 g/mol
SMILES N(CC(OC(=O)C)COc1c(C2CCCC2)cccc1)C(C)(C)C
SPLASH splash10-000i-9512000000-243c82a157790c1da8a2
Source of Spectrum CJ-1992-0-0
Synonyms 2-(tert-butylamino)-1-[(2-cyclopentylphenoxy)methyl]ethyl acetate
Wiley ID 1330371