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Ethyl 2-[(ethoxycarbonyl)amino]-3,3,3-trifluoropropanoate
SpectraBase Compound ID 6pFAnnXNK74
InChI InChI=1S/C8H12F3NO4/c1-3-15-6(13)5(8(9,10)11)12-7(14)16-4-2/h5H,3-4H2,1-2H3,(H,12,14)
InChIKey YKVQQBYRVSSEGV-UHFFFAOYSA-N
Mol Weight 243.18 g/mol
Molecular Formula C8H12F3NO4
Exact Mass 243.071842 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSpiw8611eB
Name N-(ETHOXYCARBONYL)-3,3,3-TRIFLUOROALANINE, ETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H12F3NO4
InChI InChI=1S/C8H12F3NO4/c1-3-15-6(13)5(8(9,10)11)12-7(14)16-4-2/h5H,3-4H2,1-2H3,(H,12,14)
InChIKey YKVQQBYRVSSEGV-UHFFFAOYSA-N
Molecular Weight 243.0715
SMILES N(C(OCC)=O)C(C(F)(F)F)C(=O)OCC
SPLASH splash10-0002-9400000000-8dfb8498a0eb681d0399
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany