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Ethyl 2-[(2-chloro-3-pyridinyl)amino]-3,3,3-trifluoro-2-(propionylamino)propanoate
SpectraBase Compound ID ClVqP7jID1g
InChI InChI=1S/C13H15ClF3N3O3/c1-3-9(21)20-12(13(15,16)17,11(22)23-4-2)19-8-6-5-7-18-10(8)14/h5-7,19H,3-4H2,1-2H3,(H,20,21)
InChIKey HOQZYFZFIPPABI-UHFFFAOYSA-N
Mol Weight 353.73 g/mol
Molecular Formula C13H15ClF3N3O3
Exact Mass 353.075404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Q00A8guVMz
Name Ethyl 2-[(2-chloro-3-pyridinyl)amino]-3,3,3-trifluoro-2-(propionylamino)propanoate
CAS Registry Number 298687-27-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClF3N3O3
InChI InChI=1S/C13H15ClF3N3O3/c1-3-9(21)20-12(13(15,16)17,11(22)23-4-2)19-8-6-5-7-18-10(8)14/h5-7,19H,3-4H2,1-2H3,(H,20,21)
InChIKey HOQZYFZFIPPABI-UHFFFAOYSA-N
Molecular Weight 353.729 g/mol
SMILES N(C(C(F)(F)F)(NC(=O)CC)C(=O)OCC)c1c(nccc1)Cl
SPLASH splash10-0ae9-7690000000-0ae41bfa995a9b3e2bde
Source of Spectrum AD-0-2532-0
Synonyms 2-[(2-chloro-3-pyridinyl)amino]-3,3,3-trifluoro-2-(1-oxopropylamino)propanoic acid ethyl ester 2-[(2-chloro-3-pyridyl)amino]-3,3,3-trifluoro-2-propionamido-propionic acid ethyl ester Alanine, 2-[(2-chloro-3-pyridinyl)amino]-3,3,3-trifluoro-N-(1-oxopropyl)-, ethyl ester Ethyl 2-[(2-chloranylpyridin-3-yl)amino]-3,3,3-tris(fluoranyl)-2-(propanoylamino)propanoate Ethyl 2-[(2-chloro-3-pyridyl)amino]-3,3,3-trifluoro-2-(propanoylamino)propanoate Ethyl 2-[(2-chloropyridin-3-yl)amino]-3,3,3-trifluoro-2-(propanoylamino)propanoate
Wiley ID 1430056