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2-{(2-Chloroacetyl)-[1-(4-trifluoromethylphenyl)ethyl]amino}-3-methylbutyric acid methyl ester
SpectraBase Compound ID HEE1h69mTM9
InChI InChI=1S/C17H21ClF3NO3/c1-10(2)15(16(24)25-4)22(14(23)9-18)11(3)12-5-7-13(8-6-12)17(19,20)21/h5-8,10-11,15H,9H2,1-4H3
InChIKey SOYRZBABCNYYKF-UHFFFAOYSA-N
Mol Weight 379.81 g/mol
Molecular Formula C17H21ClF3NO3
Exact Mass 379.116206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IvvcC0cmb7k
Name 2-{(2-Chloroacetyl)-[1-(4-trifluoromethylphenyl)ethyl]amino}-3-methylbutyric acid methyl ester
Alternate Name(s) Methyl 2-((chloroacetyl){1-[4-(trifluoromethyl)phenyl]ethyl}amino)-3-methylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21ClF3NO3
InChI InChI=1S/C17H21ClF3NO3/c1-10(2)15(16(24)25-4)22(14(23)9-18)11(3)12-5-7-13(8-6-12)17(19,20)21/h5-8,10-11,15H,9H2,1-4H3
InChIKey SOYRZBABCNYYKF-UHFFFAOYSA-N
Molecular Weight 379.807 g/mol
SMILES C(C(C(C)C)N(C(C)c1ccc(cc1)C(F)(F)F)C(=O)CCl)(=O)OC
SPLASH splash10-00di-0912000000-b90184e93c854f0c4bd3
Source of Spectrum KC-61-1284-5
Wiley ID 1627521