SpectraBase Spectrum ID |
JIJMcGJGOUi |
Name |
Fenoterol-A (-H2O) 4AC |
Classification |
Pharmaceutical drug artifact derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
453.178752206 u |
Formula |
C25H27NO7 |
InChI |
InChI=1S/C25H27NO7/c1-16(12-21-6-8-23(9-7-21)31-18(3)28)26(17(2)27)11-10-22-13-24(32-19(4)29)15-25(14-22)33-20(5)30/h6-11,13-16H,12H2,1-5H3/b11-10+ |
InChIKey |
MAXPLVAOBUQNIG-ZHACJKMWSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
453.491 g/mol |
Nominal Mass |
453 u |
Quality |
745 |
Retention Index |
3360 |
SMILES |
C=1(C=C(C=C(C1)OC(=O)C)OC(=O)C)\C=C\N(C(CC=1C=CC(=CC1)OC(=O)C)C)C(=O)C |
SPLASH |
splash10-03fr-0950000000-388f5069d784991babbd |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3-((E)-2-(acetyl(1-(4-(acetyloxy)phenyl)propan-2-yl)amino)ethenyl)-5-(acetyloxy)phenyl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_007822 |