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N-(Ethoxycarbonyl)-L-asparic acid .alpha.-methyl ester .beta.-semialdehyde
SpectraBase Compound ID 24IfsyxHTkc
InChI InChI=1S/C8H13NO5/c1-3-14-8(12)9-6(4-5-10)7(11)13-2/h5-6H,3-4H2,1-2H3,(H,9,12)/t6-/m0/s1
InChIKey XDJCKPAVVQSDRV-LURJTMIESA-N
Mol Weight 203.19 g/mol
Molecular Formula C8H13NO5
Exact Mass 203.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D39oH557t2X
Name N-(Ethoxycarbonyl)-L-asparic acid .alpha.-methyl ester .beta.-semialdehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO5
InChI InChI=1S/C8H13NO5/c1-3-14-8(12)9-6(4-5-10)7(11)13-2/h5-6H,3-4H2,1-2H3,(H,9,12)/t6-/m0/s1
InChIKey XDJCKPAVVQSDRV-LURJTMIESA-N
Molecular Weight 203.194 g/mol
SMILES N(C(=O)OCC)[C@](C(=O)OC)(CC=O)[H]
SPLASH splash10-0006-7900000000-4bfc7bdc8105f8579050
Source of Spectrum QC-11-4971-2
Synonyms (2S)-2-(ethoxycarbonylamino)-4-oxobutanoic acid methyl ester Methyl (2S)-2-(ethoxycarbonylamino)-4-oxobutanoate Methyl (2S)-2-(ethoxycarbonylamino)-4-oxo-butanoate Methyl (2S)-2-(ethoxycarbonylamino)-4-oxidanylidene-butanoate
Wiley ID 860268