| SpectraBase Spectrum ID |
5P5Fm8lcz3P |
| Name |
Cocaine-M (HO-BZE) 2TMS |
| Classification |
Local anesthetic
Addictive drug |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
449.205376296 u |
| Formula |
C22H35NO5Si2 |
| InChI |
InChI=1S/C22H35NO5Si2/c1-23-16-10-13-18(23)20(22(25)28-30(5,6)7)19(14-16)26-21(24)15-8-11-17(12-9-15)27-29(2,3)4/h8-9,11-12,16,18-20H,10,13-14H2,1-7H3 |
| InChIKey |
JJTCQUIHRBGGST-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
449.694 g/mol |
| SMILES |
c1(C(OC2CC3N(C(C2C(O[Si](C)(C)C)=O)CC3)C)=O)ccc(cc1)O[Si](C)(C)C |
| SPLASH |
splash10-001l-9330100000-dce3a29d1906563e24e4 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Cocaine-M (HO-benzoylecgonine) 2TMS |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6258 |
