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Salbutamol, N-TFA, O,O',O''-tris-TMS
SpectraBase Compound ID 5S5rOWi6R3u
InChI InChI=1S/C24H44F3NO4Si3/c1-23(2,3)28(22(29)24(25,26)27)16-21(32-35(10,11)12)18-13-14-20(31-34(7,8)9)19(15-18)17-30-33(4,5)6/h13-15,21H,16-17H2,1-12H3
InChIKey KAKVNWFGFSVDFD-UHFFFAOYSA-N
Mol Weight 551.9 g/mol
Molecular Formula C24H44F3NO4Si3
Exact Mass 551.253023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuXXPVs1EtB
Name Salbutamol, N-TFA, O,O',O''-tris-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 551.253022991 u
Formula C24H44F3NO4Si3
InChI InChI=1S/C24H44F3NO4Si3/c1-23(2,3)28(22(29)24(25,26)27)16-21(32-35(10,11)12)18-13-14-20(31-34(7,8)9)19(15-18)17-30-33(4,5)6/h13-15,21H,16-17H2,1-12H3
InChIKey KAKVNWFGFSVDFD-UHFFFAOYSA-N
Molecular Weight 551.869 g/mol
Nominal Mass 551 u
Number of Peaks 25
SMILES C(F)(F)(F)C(=O)N(C(C)(C)C)CC(c1ccc(O[Si](C)(C)C)c(c1)CO[Si](C)(C)C)O[Si](C)(C)C
SPLASH splash10-01b9-1009000000-192ed33bb12e413e6d96
Source File Reference DSHS_50_1141
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Synonyms Albuterol, N-TFA, O,O',O''-tris-TMS
Wiley ID 50_1141