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Glutaric acid (2-nitrobenzyl-a,a-D2) ester methyl ester
SpectraBase Compound ID 3f859sKdgfe
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/i9D2
InChIKey WDXSYHWPGKIHKN-KNXIQCGSSA-N
Mol Weight 283.28 g/mol
Molecular Formula C13H13D2NO6
Exact Mass 283.102491 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oGAxEzqjT3
Name Glutaric acid (2-nitrobenzyl-a,a-D2) ester methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13D2NO6
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/i9D2
InChIKey WDXSYHWPGKIHKN-KNXIQCGSSA-N
Literature Reference DOI 10.1021/ol070820h
Molecular Weight 283.276 g/mol
SMILES C([D])(c1c([N+](=O)[O-])cccc1)(OC(CCCC(OC)=O)=O)[D]
SPLASH splash10-0fbi-0900000000-dc36b61a8263ac8edaf7
Source of Spectrum A1-9-2649/SMS10-Table3,entry5
Wiley ID 1758208