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Neostigmine
SpectraBase Compound ID AT5IL387MUI
InChI InChI=1S/C11H16N2O2/c1-12(2)9-6-5-7-10(8-9)15-11(14)13(3)4/h5-8H,1-4H3
InChIKey FWNHTEHWJKUVPG-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C11H16N2O2
Exact Mass 208.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JBUCxRHdq4
Name Neostigmine bromide-A (-CH3Br)
Classification Pharmaceutical drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 208.121177761 u
Formula C11H16N2O2
InChI InChI=1S/C11H16N2O2/c1-12(2)9-6-5-7-10(8-9)15-11(14)13(3)4/h5-8H,1-4H3
InChIKey FWNHTEHWJKUVPG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 208.261 g/mol
Nominal Mass 208 u
Quality 993
Retention Index 1634
SMILES C=1(C=C(N(C)C)C=CC1)OC(N(C)C)=O
SPLASH splash10-05fr-9140000000-e3651ec663fb8bdcd8fc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-(dimethylamino)phenyl dimethylcarbamate
Technique GC/MS
Wiley ID DD2024_003173