SpectraBase Spectrum ID |
2mbzMuww4TQ |
Name |
Tropacocaine |
CAS Registry Number |
537-26-8 |
Classification |
Pharmaceutical drug, local anesthetic |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
245.141578854 u |
Formula |
C15H19NO2 |
InChI |
InChI=1S/C15H19NO2/c1-16-12-7-8-13(16)10-14(9-12)18-15(17)11-5-3-2-4-6-11/h2-6,12-14H,7-10H2,1H3/t12-,13+,14- |
InChIKey |
XQJMXPAEFMWDOZ-BTTYYORXSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
245.322 g/mol |
Nominal Mass |
245 u |
Retention Index |
1950 |
SMILES |
[C@]1(C[C@@]2(N([C@](C1)(CC2)[H])C)[H])(OC(C=1C=CC=CC1)=O)[H] |
SPLASH |
splash10-00ec-9500000000-6779ff462509781997de |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Benzoyl-pseudotropein
(8-Methyl-8-azabicyclo[3.2.1]oct-3-yl) benzoate |
Technique |
GC/MS |
Wiley ID |
DD2024_034822 |