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Ethyl 2-(benzylamino)-2-(butyrylamino)-3,3,3-trifluoropropanoate
SpectraBase Compound ID 8gCk6g0zNGI
InChI InChI=1S/C16H21F3N2O3/c1-3-8-13(22)21-15(16(17,18)19,14(23)24-4-2)20-11-12-9-6-5-7-10-12/h5-7,9-10,20H,3-4,8,11H2,1-2H3,(H,21,22)
InChIKey CSCMPOCLHJQLFR-UHFFFAOYSA-N
Mol Weight 346.35 g/mol
Molecular Formula C16H21F3N2O3
Exact Mass 346.150427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLFjEIatf2w
Name Ethyl 2-(benzylamino)-2-(butyrylamino)-3,3,3-trifluoropropanoate
CAS Registry Number 339352-52-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21F3N2O3
InChI InChI=1S/C16H21F3N2O3/c1-3-8-13(22)21-15(16(17,18)19,14(23)24-4-2)20-11-12-9-6-5-7-10-12/h5-7,9-10,20H,3-4,8,11H2,1-2H3,(H,21,22)
InChIKey CSCMPOCLHJQLFR-UHFFFAOYSA-N
Molecular Weight 346.350 g/mol
SMILES N(Cc1ccccc1)C(C(=O)OCC)(C(F)(F)F)NC(=O)CCC
SPLASH splash10-0006-9320000000-133be8d8e04ae59f3818
Synonyms 2-(benzylamino)-2-butyramido-3,3,3-trifluoro-propionic acid ethyl ester 3,3,3-trifluoro-2-(1-oxobutylamino)-2-[(phenylmethyl)amino]propanoic acid ethyl ester Ethyl 2-(benzylamino)-2-(butanoylamino)-3,3,3-trifluoro-propanoate Ethyl 2-(butanoylamino)-3,3,3-tris(fluoranyl)-2-[(phenylmethyl)amino]propanoate Ethyl 2-benzylamino-2-butyramido-3,3,3-trifluoropropionate
Wiley ID 1469193