| SpectraBase Spectrum ID |
FXopLqelRWm |
| Name |
Norcocaine TMS |
| Classification |
Drug metabolite derivative |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
361.170934884 u |
| Formula |
C19H27NO4Si |
| InChI |
InChI=1S/C19H27NO4Si/c1-23-19(22)17-15-11-10-14(20(15)25(2,3)4)12-16(17)24-18(21)13-8-6-5-7-9-13/h5-9,14-17H,10-12H2,1-4H3/t14-,15+,16-,17+/m0/s1 |
| InChIKey |
PYMCJJKQPSZSEU-VVLHAWIVSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
361.513 g/mol |
| Nominal Mass |
361 u |
| Quality |
993 |
| Retention Index |
2774 |
| SMILES |
[C@]1([C@](C[C@]2(N([C@@]1(CC2)[H])[Si](C)(C)C)[H])(OC(C1=CC=CC=C1)=O)[H])(C(OC)=O)[H] |
| SPLASH |
splash10-052f-5920000000-8699954b8c89ba4cd366 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
methyl 3-(benzoyloxy)-8-(trimethylsilyl)-8-azabicyclo[3.2.1]octane-2-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_023517 |
