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2-(E)-Pentensaeure, (4S)-amino-5-phenyl-, ethylester, hydrochlorid
SpectraBase Compound ID 4oUu1LkE9Uk
InChI InChI=1S/C13H17NO2.ClH/c1-2-16-13(15)9-8-12(14)10-11-6-4-3-5-7-11;/h3-9,12H,2,10,14H2,1H3;1H/b9-8+;
InChIKey CBZBTIIASFZCDN-HRNDJLQDSA-N
Mol Weight 255.74 g/mol
Molecular Formula C13H18ClNO2
Exact Mass 255.102607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xBFClxS2OE
Name 2-(E)-Pentensaeure, (4S)-amino-5-phenyl-, ethylester, hydrochlorid
Alternate Name(s) (3E)-5-ethoxy-5-oxo-1-phenyl-3-penten-2-aminium chloride 5-Ethoxy-5-oxo-1-phenyl-3-penten-2-aminium chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18ClNO2
InChI InChI=1S/C13H17NO2.ClH/c1-2-16-13(15)9-8-12(14)10-11-6-4-3-5-7-11;/h3-9,12H,2,10,14H2,1H3;1H/b9-8+;
InChIKey CBZBTIIASFZCDN-HRNDJLQDSA-N
Molecular Weight 255.745 g/mol
SMILES [Cl-].[NH3+]C(\C=C\C(OCC)=O)Cc1ccccc1
SPLASH splash10-004i-6900000000-a37599cc26fdcf56e10d
Wiley ID 1492112