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Glutaric acid (2-nitrobenzyl) ester methyl ester
SpectraBase Compound ID 656ZZ9PvMyj
InChI InChI=1S/C13H15NO6/c1-19-12(15)7-4-8-13(16)20-9-10-5-2-3-6-11(10)14(17)18/h2-3,5-6H,4,7-9H2,1H3
InChIKey WDXSYHWPGKIHKN-UHFFFAOYSA-N
Mol Weight 281.26 g/mol
Molecular Formula C13H15NO6
Exact Mass 281.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOHT2a6QMDR
Name Glutaric acid (2-nitrobenzyl) ester methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO6
InChI InChI=1S/C13H15NO6/c1-19-12(15)7-4-8-13(16)20-9-10-5-2-3-6-11(10)14(17)18/h2-3,5-6H,4,7-9H2,1H3
InChIKey WDXSYHWPGKIHKN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol070820h
Molecular Weight 281.264 g/mol
SMILES C(c1c([N+](=O)[O-])cccc1)OC(CCCC(OC)=O)=O
SPLASH splash10-0fbi-0900000000-9223e3cea7ad34ca525e
Source of Spectrum A1-9-2649/SMS9-Table3,entry4
Synonyms Methyl 2-nitrobenzyl glutarate
Wiley ID 1758207