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Orciprenaline 3TMSTFA
SpectraBase Compound ID B0KADavRY6y
InChI InChI=1S/C22H40F3NO4Si3/c1-16(2)26(21(27)22(23,24)25)15-20(30-33(9,10)11)17-12-18(28-31(3,4)5)14-19(13-17)29-32(6,7)8/h12-14,16,20H,15H2,1-11H3
InChIKey XVPLWDATQNALIO-UHFFFAOYSA-N
Mol Weight 523.8 g/mol
Molecular Formula C22H40F3NO4Si3
Exact Mass 523.221723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jQOC1tMWG
Name Orciprenaline 3TMSTFA
Classification Sympathomimetic
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Exact Mass 523.221722862 u
Formula C22H40F3NO4Si3
InChI InChI=1S/C22H40F3NO4Si3/c1-16(2)26(21(27)22(23,24)25)15-20(30-33(9,10)11)17-12-18(28-31(3,4)5)14-19(13-17)29-32(6,7)8/h12-14,16,20H,15H2,1-11H3
InChIKey XVPLWDATQNALIO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 523.815 g/mol
SMILES c1(cc(O[Si](C)(C)C)cc(O[Si](C)(C)C)c1)C(O[Si](C)(C)C)CN(C(C)C)C(=O)C(F)(F)F
SPLASH splash10-0ab9-7219000000-3f2e701ba9d325bb47dc
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_6166