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(2Z)-Ethyl 3-Amino-5-(4-chlorophenyl)pent-2-enoate
SpectraBase Compound ID J1rmCPDvE4l
InChI InChI=1S/C13H16ClNO2/c1-2-17-13(16)9-12(15)8-5-10-3-6-11(14)7-4-10/h3-4,6-7,9H,2,5,8,15H2,1H3/b12-9-
InChIKey IENBLCSKDXMYQK-XFXZXTDPSA-N
Mol Weight 253.73 g/mol
Molecular Formula C13H16ClNO2
Exact Mass 253.086956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VMqfdinkq7
Name (2Z)-Ethyl 3-Amino-5-(4-chlorophenyl)pent-2-enoate
Appearance Colorless resin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClNO2
InChI InChI=1S/C13H16ClNO2/c1-2-17-13(16)9-12(15)8-5-10-3-6-11(14)7-4-10/h3-4,6-7,9H,2,5,8,15H2,1H3/b12-9-
InChIKey IENBLCSKDXMYQK-XFXZXTDPSA-N
Instrument Name Finnigan MAT TSQ 70
Ionization Type EI
Literature Reference DOI 10.1021/jm900212y
Molecular Weight 253.729 g/mol
SMILES N\C(=C/C(OCC)=O)CCc1ccc(cc1)Cl
SPLASH splash10-0fvi-1960000000-900921434b6e8a5c62c9
Source of Spectrum AF-52-SM13-7n
Wiley ID 1873591