SpectraBase Spectrum ID |
B1Tsvy14FXM |
Name |
Amphethamine glucoside 4TMS |
Classification |
Drug glucuronide |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
585.315730010 u |
Formula |
C27H55NO5Si4 |
InChI |
InChI=1S/C27H55NO5Si4/c1-21(19-22-17-15-14-16-18-22)28-27-26(33-37(11,12)13)25(32-36(8,9)10)24(31-35(5,6)7)23(30-27)20-29-34(2,3)4/h14-18,21,23-28H,19-20H2,1-13H3/t21?,23-,24-,25+,26-,27+/m1/s1 |
InChIKey |
PCKGHLIBKKQELA-HDWIHQJUSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
586.079 g/mol |
Nominal Mass |
585 u |
Quality |
991 |
Retention Index |
4116 |
SMILES |
[C@@]1([C@]([C@@]([C@](O[C@@]1(NC(CC1=CC=CC=C1)C)[H])(CO[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H] |
SPLASH |
splash10-0609-5593500000-44a3aa6fb243472aa31f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(1-phenylpropan-2-yl)-3,4,5-tris((trimethylsilyl)oxy)-6-(((trimethylsilyl)oxy)methyl)oxan-2-amine |
Technique |
GC/MS |
Wiley ID |
DD2024_018804 |