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N-benzoyl-3-nitrophenylalanine methyl ester
SpectraBase Compound ID 1DuHCfRaNzv
InChI InChI=1S/C17H16N2O5/c1-24-17(21)15(18-16(20)13-7-3-2-4-8-13)11-12-6-5-9-14(10-12)19(22)23/h2-10,15H,11H2,1H3,(H,18,20)/t15-/m0/s1
InChIKey NCQLWBSFEOWNQP-HNNXBMFYSA-N
Mol Weight 328.32 g/mol
Molecular Formula C17H16N2O5
Exact Mass 328.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BupF110ueKg
Name N-benzoyl-3-nitrophenylalanine methyl ester
CAS Registry Number 121137-21-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O5
InChI InChI=1S/C17H16N2O5/c1-24-17(21)15(18-16(20)13-7-3-2-4-8-13)11-12-6-5-9-14(10-12)19(22)23/h2-10,15H,11H2,1H3,(H,18,20)/t15-/m0/s1
InChIKey NCQLWBSFEOWNQP-HNNXBMFYSA-N
Molecular Weight 328.324 g/mol
SMILES N(C(=O)c1ccccc1)[C@@](Cc1cc(N(=O)=O)ccc1)(C(=O)OC)[H]
SPLASH splash10-0a6r-3910000000-4f900a598b7ede1e7d7c
Source of Spectrum B-41-1068-4
Synonyms Methyl (2S)-2-(benzoylamino)-3-(3-nitrophenyl)propanoate Methyl 2-benzoylamino-3-phenylpropanoate
Wiley ID 1326109