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Tiropramide

View entire compound with spectra: 4 MS (GC)

Tiropramide
SpectraBase Compound ID Gp9ws8gPf16
InChI InChI=1S/C28H41N3O3/c1-5-18-31(19-6-2)28(33)26(29-27(32)24-12-10-9-11-13-24)22-23-14-16-25(17-15-23)34-21-20-30(7-3)8-4/h9-17,26H,5-8,18-22H2,1-4H3,(H,29,32)
InChIKey FDBWMYOFXWMGEY-UHFFFAOYSA-N
Mol Weight 467.7 g/mol
Molecular Formula C28H41N3O3
Exact Mass 467.314792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQOeFgpfFMR
Name Tiropramide
CAS Registry Number 55837-29-1
Comments Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821070
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H41N3O3
InChI InChI=1S/C28H41N3O3/c1-5-18-31(19-6-2)28(33)26(29-27(32)24-12-10-9-11-13-24)22-23-14-16-25(17-15-23)34-21-20-30(7-3)8-4/h9-17,26H,5-8,18-22H2,1-4H3,(H,29,32)
InChIKey FDBWMYOFXWMGEY-UHFFFAOYSA-N
Molecular Weight 467.654 g/mol
SMILES N(C(c1ccccc1)=O)C(C(N(CCC)CCC)=O)Cc1ccc(cc1)OCCN(CC)CC
SPLASH splash10-000i-9200000000-8f36d5c67bd13520ef04
Source of Spectrum KO-15-207-2
Synonyms N-[3-[4-(2-diethylaminoethyloxy)phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]benzamide N-[3-[4-[2-(diethylamino)ethoxy]phenyl]-1-(dipropylamino)-1-oxopropan-2-yl]benzamide N-[1-[[4-[2-(diethylamino)ethoxy]phenyl]methyl]-2-(dipropylamino)-2-oxo-ethyl]benzamide N-[3-[4-[2-(diethylamino)ethoxy]phenyl]-1-(dipropylamino)-1-oxidanylidene-propan-2-yl]benzamide
Wiley ID 1392217