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(2R,3R)-Methyl 2-(4-methoxyphenylamino)-3-nitro-4-(thiophen-2- yl)butanoate
SpectraBase Compound ID 4qMgCR4lTN8
InChI InChI=1S/C16H18N2O5S/c1-22-12-7-5-11(6-8-12)17-15(16(19)23-2)14(18(20)21)10-13-4-3-9-24-13/h3-9,14-15,17H,10H2,1-2H3/t14-,15-/m1/s1
InChIKey XFDCCJJAYJEBKT-HUUCEWRRSA-N
Mol Weight 350.39 g/mol
Molecular Formula C16H18N2O5S
Exact Mass 350.093643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EenNawwPodG
Name (2R,3R)-Methyl 2-(4-methoxyphenylamino)-3-nitro-4-(thiophen-2- yl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2O5S
InChI InChI=1S/C16H18N2O5S/c1-22-12-7-5-11(6-8-12)17-15(16(19)23-2)14(18(20)21)10-13-4-3-9-24-13/h3-9,14-15,17H,10H2,1-2H3/t14-,15-/m1/s1
InChIKey XFDCCJJAYJEBKT-HUUCEWRRSA-N
Literature Reference DOI 10.1021/ol8003589
Molecular Weight 350.389 g/mol
SMILES N([C@@](C(OC)=O)([C@@](Cc1cccs1)([N+](=O)[O-])[H])[H])c1ccc(cc1)OC
SPLASH splash10-008a-6921000000-aef932110eb5fed45553
Source of Spectrum A1-10-1731/SMS9-4h
Synonyms (2R,3R)-methyl 2-((4-methoxyphenyl)amino)-3-nitro-4-(thiophen-2-yl)butanoate
Wiley ID 1759348