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NO NAME

Compound with spectra: 1 NMR, and 2 MS (GC)

NO NAME
SpectraBase Compound ID 3vce4SHxWAm
InChI InChI=1S/C12H15NO3/c1-2-16-12(15)11(13-9-14)8-10-6-4-3-5-7-10/h3-7,9,11H,2,8H2,1H3,(H,13,14)/t11-/m0/s1
InChIKey WGLPNLBKPWJSAP-NSHDSACASA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol
Enantiomer InChIKey WGLPNLBKPWJSAP-LLVKDONJSA-N
Racemate InChIKey WGLPNLBKPWJSAP-UHFFFAOYSA-N

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MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum A1-13-3952/SMS4-2b

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MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum A1-9-2621/SMS12-S_14b

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13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
  • N-formyl Phe-OEt
N-formyl Phe-OEt-D1
N-formyl Phe-OEt-D1
(S)-N-Methylphenylalanine allyl ester hydrotrifluoro acetate
Ethyl 2-dimethylamino-3-phenylpropanoate
3-Phenyl-2-(propylamino)propanoic acid methyl ester
Methyl 2-[N-isopropylamino]-3-phenylpropanoate
2-(cyanomethylamino)-3-phenyl-propionic acid methyl ester
METHYL-(2S)-2-[(CYANOMETHYL)-AMINO]-3-PHENYLPROPANOATE
phenylalanine, N-(aminocarbonyl)-
(2S)-2-(carbamoylamino)-3-phenylpropanoic acid
(S)-(α-carboxyphenethyl)trimethylammonium chloride, methyl ester
ETHYL-2-BENZYL-2-ISOTHIOCYANATOCARBOXYLATE
Title Journal or Book Year
2,2,2-Trifluoroethyl Formate:  A Versatile and Selective Reagent for the Formylation of Alcohols, Amines, andN-Hydroxylamines Organic Letters 2001

Wiley Registry of Mass Spectral Data 12th Edition
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