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Pimelic acid, 3-nitrobenzyl ethyl ester
SpectraBase Compound ID G734ZhLabyV
InChI InChI=1S/C16H21NO6/c1-2-22-15(18)9-4-3-5-10-16(19)23-12-13-7-6-8-14(11-13)17(20)21/h6-8,11H,2-5,9-10,12H2,1H3
InChIKey SZBMKNUXHNRCFW-UHFFFAOYSA-N
Mol Weight 323.35 g/mol
Molecular Formula C16H21NO6
Exact Mass 323.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BMEZvENYe
Name Pimelic acid, 3-nitrobenzyl ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO6
InChI InChI=1S/C16H21NO6/c1-2-22-15(18)9-4-3-5-10-16(19)23-12-13-7-6-8-14(11-13)17(20)21/h6-8,11H,2-5,9-10,12H2,1H3
InChIKey SZBMKNUXHNRCFW-UHFFFAOYSA-N
Molecular Weight 323.345 g/mol
SMILES C(CCCCCC(OCc1cccc(c1)N(=O)=O)=O)(OCC)=O
SPLASH splash10-000i-7900000000-7725fda1e09aa6ab0a50
Source of Spectrum TIPS-2022-693-0
Wiley ID 1822210