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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 1wKDQvDs83S
Name N-(tert-Butyl)-2,2,2-trifluoro-N-[2-[(trimethylsilyl)oxy]-2-(4-[(trimethylsilyl)oxy]-3-([(trimethylsilyl)oxy]methyl)phenyl)ethyl]acetamide
Alternate Name(s) Salbutamol, N-trifluoroacetyl-O,O,o-tris(trimethylsilyl)deriv. N-tert-butyl-2,2,2-tris(fluoranyl)-N-[2-trimethylsilyloxy-2-[4-trimethylsilyloxy-3-(trimethylsilyloxymethyl)phenyl]ethyl]ethanamide
CAS Registry Number 325836-94-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
SMILES c1(cc(C(O[Si](C)(C)C)CN(C(C(F)(F)F)=O)C(C)(C)C)ccc1O[Si](C)(C)C)CO[Si](C)(C)C
SPLASH splash10-01b9-1009000000-ebcb7bbd1badb2f7b0ef
Source of Spectrum NP-15-9575-0
Wiley ID 1113025