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2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid 4-(ethylamino)but-2-ynyl ester
SpectraBase Compound ID GEMZf798ocP
InChI InChI=1S/C20H27NO3/c1-2-21-15-9-10-16-24-19(22)20(23,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3,5-6,11-12,18,21,23H,2,4,7-8,13-16H2,1H3
InChIKey SNIBJKHIKIIGPR-UHFFFAOYSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lNgyIoFFZV
Name 2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid 4-(ethylamino)but-2-ynyl ester
CAS Registry Number 80976-67-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-2-21-15-9-10-16-24-19(22)20(23,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3,5-6,11-12,18,21,23H,2,4,7-8,13-16H2,1H3
InChIKey SNIBJKHIKIIGPR-UHFFFAOYSA-N
Molecular Weight 329.440 g/mol
SMILES N(CC#CCOC(C(c1ccccc1)(C1CCCCC1)O)=O)CC
SPLASH splash10-052k-9710000000-8705849576526687275e
Source of Spectrum KO-8-508-0
Synonyms 4-(ethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate 4-(ethylamino)but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate Deethyloxybutynin Desethyloxybutynin N-Desethyloxybutynin 2-cyclohexyl-2-hydroxy-2-phenylacetic acid 4-(ethylamino)but-2-ynyl ester
Wiley ID 1327232