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Alanine, 2-methoxy-N-(3-nitrobenzoyl)-, methyl ester
SpectraBase Compound ID 5SYGlMJxPcg
InChI InChI=1S/C12H14N2O6/c1-12(20-3,11(16)19-2)13-10(15)8-5-4-6-9(7-8)14(17)18/h4-7H,1-3H3,(H,13,15)/t12-/m1/s1
InChIKey NMQRGLIMGFGYTR-GFCCVEGCSA-N
Mol Weight 282.25 g/mol
Molecular Formula C12H14N2O6
Exact Mass 282.085186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPg7Gs2z9lJ
Name Alanine, 2-methoxy-N-(3-nitrobenzoyl)-, methyl ester
Alternate Name(s) .alpha.-methoxy-N-(3-nitrobenzoyl)-alanine methyl ester Methyl (2R)-2-methoxy-2-[(3-nitrobenzoyl)amino]propanoate
CAS Registry Number 125700-24-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O6
InChI InChI=1S/C12H14N2O6/c1-12(20-3,11(16)19-2)13-10(15)8-5-4-6-9(7-8)14(17)18/h4-7H,1-3H3,(H,13,15)/t12-/m1/s1
InChIKey NMQRGLIMGFGYTR-GFCCVEGCSA-N
Molecular Weight 282.252 g/mol
SMILES N(C(c1cc(N(=O)=O)ccc1)=O)[C@@](C(=O)OC)(OC)C
SPLASH splash10-0fmi-9570000000-f81c63cbe5e7c52db5b2
Source of Spectrum F-45-1698-4
Wiley ID 1285403