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Bambuterol AC
SpectraBase Compound ID E1DWHe1PtHA
InChI InChI=1S/C20H31N3O6/c1-13(24)27-17(12-21-20(2,3)4)14-9-15(28-18(25)22(5)6)11-16(10-14)29-19(26)23(7)8/h9-11,17,21H,12H2,1-8H3
InChIKey HSYPGQUPWNXHRX-UHFFFAOYSA-N
Mol Weight 409.48 g/mol
Molecular Formula C20H31N3O6
Exact Mass 409.221286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7gEd3W9Jh7
Name Bambuterol AC
Classification Bronchodilator
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Exact Mass 409.221285724 u
Formula C20H31N3O6
InChI InChI=1S/C20H31N3O6/c1-13(24)27-17(12-21-20(2,3)4)14-9-15(28-18(25)22(5)6)11-16(10-14)29-19(26)23(7)8/h9-11,17,21H,12H2,1-8H3
InChIKey HSYPGQUPWNXHRX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 409.483 g/mol
SMILES c1c(cc(cc1OC(N(C)C)=O)C(OC(C)=O)CNC(C)(C)C)OC(=O)N(C)C
SPLASH splash10-00dr-9000000000-1f294ffcf07da2bc2aa8
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_7548