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Orciprenaline, N,O,O'-tris-TFA, O''-TMS
SpectraBase Compound ID 1nXEXv6cPp
InChI InChI=1S/C20H22F9NO6Si/c1-10(2)30(15(31)18(21,22)23)9-14(36-37(3,4)5)11-6-12(34-16(32)19(24,25)26)8-13(7-11)35-17(33)20(27,28)29/h6-8,10,14H,9H2,1-5H3
InChIKey HGGLDIMJNBSIEM-UHFFFAOYSA-N
Mol Weight 571.47 g/mol
Molecular Formula C20H22F9NO6Si
Exact Mass 571.107267 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dio8vjVPpnS
Name Orciprenaline, N,O,O'-tris-TFA, O''-TMS
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 571.107267428 u
Formula C20H22F9NO6Si
InChI InChI=1S/C20H22F9NO6Si/c1-10(2)30(15(31)18(21,22)23)9-14(36-37(3,4)5)11-6-12(34-16(32)19(24,25)26)8-13(7-11)35-17(33)20(27,28)29/h6-8,10,14H,9H2,1-5H3
InChIKey HGGLDIMJNBSIEM-UHFFFAOYSA-N
Molecular Weight 571.468 g/mol
Nominal Mass 571 u
Number of Peaks 51
SMILES C(F)(F)(F)C(=O)Oc1cc(C(O[Si](C)(C)C)CN(C(C)C)C(C(F)(F)F)=O)cc(OC(C(F)(F)F)=O)c1
SPLASH splash10-0udi-6221900000-6deeae84a2c47e6e1ce2
Source File Reference DSHS_50_0599
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Wiley ID 50_599