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(2S)-2-(benzyloxycarbonylamino)-4-bromo-butyric acid ethyl ester

View entire compound with spectra: 1 MS (GC)

(2S)-2-(benzyloxycarbonylamino)-4-bromo-butyric acid ethyl ester
SpectraBase Compound ID 7TKJOSWHkGi
InChI InChI=1S/C14H18BrNO4/c1-2-19-13(17)12(8-9-15)16-14(18)20-10-11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3,(H,16,18)/t12-/m0/s1
InChIKey ADNZQMIJTCQKIX-LBPRGKRZSA-N
Mol Weight 344.21 g/mol
Molecular Formula C14H18BrNO4
Exact Mass 343.041921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DezamLHOSVe
Name (2S)-2-(benzyloxycarbonylamino)-4-bromo-butyric acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18BrNO4
InChI InChI=1S/C14H18BrNO4/c1-2-19-13(17)12(8-9-15)16-14(18)20-10-11-6-4-3-5-7-11/h3-7,12H,2,8-10H2,1H3,(H,16,18)/t12-/m0/s1
InChIKey ADNZQMIJTCQKIX-LBPRGKRZSA-N
Molecular Weight 344.205 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@](C(=O)OCC)(CCBr)[H]
SPLASH splash10-0006-9250000000-0a51cacab92764817890
Source of Spectrum J-59-7632-7
Synonyms (2S)-4-bromo-2-(phenylmethoxycarbonylamino)butanoic acid ethyl ester Ethyl (2S)-4-bromanyl-2-(phenylmethoxycarbonylamino)butanoate Ethyl (2S)-4-bromo-2-(phenylmethoxycarbonylamino)butanoate
Wiley ID 1337135