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(E,S)-2-pentensaeure, 4-amino-5-phenyl-, methylester, hydrochlorid

View entire compound with spectra: 2 MS (GC)

(E,S)-2-pentensaeure, 4-amino-5-phenyl-, methylester, hydrochlorid
SpectraBase Compound ID 6SmTqRJZjXt
InChI InChI=1S/C12H15NO2.ClH/c1-15-12(14)8-7-11(13)9-10-5-3-2-4-6-10;/h2-8,11H,9,13H2,1H3;1H/b8-7+;
InChIKey LADMWHRBARCAKA-USRGLUTNSA-N
Mol Weight 241.72 g/mol
Molecular Formula C12H16ClNO2
Exact Mass 241.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EZZBPBU7JH
Name (E,S)-2-pentensaeure, 4-amino-5-phenyl-, methylester, hydrochlorid
Alternate Name(s) (3E)-5-methoxy-5-oxo-1-phenyl-3-penten-2-aminium chloride 5-Methoxy-5-oxo-1-phenyl-3-penten-2-aminium chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16ClNO2
InChI InChI=1S/C12H15NO2.ClH/c1-15-12(14)8-7-11(13)9-10-5-3-2-4-6-10;/h2-8,11H,9,13H2,1H3;1H/b8-7+;
InChIKey LADMWHRBARCAKA-USRGLUTNSA-N
Molecular Weight 241.718 g/mol
SMILES [Cl-].[NH3+]C(Cc1ccccc1)\C=C\C(=O)OC
SPLASH splash10-03di-7900000000-5d33932d76fab9aebd2b
Wiley ID 1490317