| SpectraBase Spectrum ID |
GYTZcXQ2KkS |
| Name |
Ecgonine 2TMS |
| Classification |
Drug derivative |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
329.184246929 u |
| Formula |
C15H31NO3Si2 |
| InChI |
InChI=1S/C15H31NO3Si2/c1-16-11-8-9-12(16)14(15(17)19-21(5,6)7)13(10-11)18-20(2,3)4/h11-14H,8-10H2,1-7H3/t11-,12+,13-,14+/m0/s1 |
| InChIKey |
ARJVVXRHOLBHAX-RFQIPJPRSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
329.587 g/mol |
| Nominal Mass |
329 u |
| Quality |
998 |
| Retention Index |
1642 |
| SMILES |
[C@@]1([C@@]([C@@]2(N([C@](C1)(CC2)[H])C)[H])(C(O[Si](C)(C)C)=O)[H])(O[Si](C)(C)C)[H] |
| SPLASH |
splash10-001j-9100000000-b9d463bd3b6c30f4b3d2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Bis(trimethylsilyl)ecgonine
3beta-Hydroxytropan-2beta-carboxylic acid 2TMS
3beta-Hydroxytropan-2beta-carboxylic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_021715 |
