SpectraBase Spectrum ID |
qJnNvgiXgz |
Name |
Orciprenaline, N,O-bis-TFA, O',O''-bis-TMS |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
547.164495145 u |
Formula |
C21H31F6NO5Si2 |
InChI |
InChI=1S/C21H31F6NO5Si2/c1-13(2)28(18(29)20(22,23)24)12-17(33-35(6,7)8)14-9-15(31-19(30)21(25,26)27)11-16(10-14)32-34(3,4)5/h9-11,13,17H,12H2,1-8H3 |
InChIKey |
VJRVXHOJJDREAS-UHFFFAOYSA-N |
Molecular Weight |
547.641 g/mol |
Nominal Mass |
547 u |
Number of Peaks |
43 |
SMILES |
C(F)(F)(F)C(=O)Oc1cc(cc(c1)O[Si](C)(C)C)C(CN(C(C(F)(F)F)=O)C(C)C)O[Si](C)(C)C |
SPLASH |
splash10-004i-1009000000-22094ce633c4ed10686c |
Source File Reference |
DSHS_50_0598 |
Source of Spectrum |
Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany |
Wiley ID |
50_598 |