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Phthalic acid, ethyl 2-(4-nitrophenoxy)ethyl ester

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Phthalic acid, ethyl 2-(4-nitrophenoxy)ethyl ester
SpectraBase Compound ID JbPd6PlFysf
InChI InChI=1S/C18H17NO7/c1-2-24-17(20)15-5-3-4-6-16(15)18(21)26-12-11-25-14-9-7-13(8-10-14)19(22)23/h3-10H,2,11-12H2,1H3
InChIKey YVCLFAWLRDETFF-UHFFFAOYSA-N
Mol Weight 359.33 g/mol
Molecular Formula C18H17NO7
Exact Mass 359.100502 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FllA2DrLkid
Name Phthalic acid, ethyl 2-(4-nitrophenoxy)ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.100501884 u
Formula C18H17NO7
InChI InChI=1S/C18H17NO7/c1-2-24-17(20)15-5-3-4-6-16(15)18(21)26-12-11-25-14-9-7-13(8-10-14)19(22)23/h3-10H,2,11-12H2,1H3
InChIKey YVCLFAWLRDETFF-UHFFFAOYSA-N
Molecular Weight 359.334 g/mol
SMILES C1=CC(=C(C=C1)C(=O)OCCOC1=CC=C(C=C1)N(=O)=O)C(=O)OCC