For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Glutaric acid, 2-ethylhexyl 3-nitrophenyl ester
SpectraBase Compound ID BiglQaopK0K
InChI InChI=1S/C19H27NO6/c1-3-5-8-15(4-2)14-25-18(21)11-7-12-19(22)26-17-10-6-9-16(13-17)20(23)24/h6,9-10,13,15H,3-5,7-8,11-12,14H2,1-2H3
InChIKey JWYFOECVZSCEEV-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C19H27NO6
Exact Mass 365.183838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IktzxFpXslq
Name Glutaric acid, 2-ethylhexyl 3-nitrophenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 365.183837587 u
Formula C19H27NO6
InChI InChI=1S/C19H27NO6/c1-3-5-8-15(4-2)14-25-18(21)11-7-12-19(22)26-17-10-6-9-16(13-17)20(23)24/h6,9-10,13,15H,3-5,7-8,11-12,14H2,1-2H3
InChIKey JWYFOECVZSCEEV-UHFFFAOYSA-N
Molecular Weight 365.426 g/mol
SMILES C(CCC(OCC(CC)CCCC)=O)C(OC1=CC=CC(=C1)N(=O)=O)=O