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Tropacocaine
SpectraBase Compound ID 1HtW48X8tMI
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
Mol Weight 245.32 g/mol
Molecular Formula C15H19NO2
Exact Mass 245.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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