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Crotethamide
SpectraBase Compound ID 6p7X5XPgUuF
InChI InChI=1S/C12H22N2O2/c1-6-9-11(15)14(8-3)10(7-2)12(16)13(4)5/h6,9-10H,7-8H2,1-5H3/b9-6+
InChIKey LSAMUAYPDHUBQD-RMKNXTFCSA-N
Mol Weight 226.32 g/mol
Molecular Formula C12H22N2O2
Exact Mass 226.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkSiscKJpeS
Name Crotetamide
CAS Registry Number 6168-76-9
Classification Pharmaceutical drug, respiratory stimulant
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 226.168127954 u
Formula C12H22N2O2
InChI InChI=1S/C12H22N2O2/c1-6-9-11(15)14(8-3)10(7-2)12(16)13(4)5/h6,9-10H,7-8H2,1-5H3/b9-6+
InChIKey LSAMUAYPDHUBQD-RMKNXTFCSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 226.320 g/mol
Nominal Mass 226 u
Quality 971
Retention Index 1709
SMILES C(N(C(\C=C\C)=O)CC)(C(N(C)C)=O)CC
SPLASH splash10-000i-9300000000-e02344e0f2510a287617
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Crotethamide (E)-N-(1-Dimethylamino-1-oxobutan-2-yl)-N-ethylbut-2-enamide
Technique GC/MS
Wiley ID DD2024_000827