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5-(4-carbomethoxy-2-nitro-phenoxy)benzene-1,3-dicarboxylic acid dimethyl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

5-(4-carbomethoxy-2-nitro-phenoxy)benzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID AyCXpbJagdt
InChI InChI=1S/C18H15NO9/c1-25-16(20)10-4-5-15(14(9-10)19(23)24)28-13-7-11(17(21)26-2)6-12(8-13)18(22)27-3/h4-9H,1-3H3
InChIKey NZUIFJUDFWPJPN-UHFFFAOYSA-N
Mol Weight 389.32 g/mol
Molecular Formula C18H15NO9
Exact Mass 389.074681 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5B3TQcw27ZH
Name Dimethyl 5-[4-(methoxycarbonyl)-2-nitrophenoxy]isophthalate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 371734
CAS Registry Number 100596-39-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO9
InChI InChI=1S/C18H15NO9/c1-25-16(20)10-4-5-15(14(9-10)19(23)24)28-13-7-11(17(21)26-2)6-12(8-13)18(22)27-3/h4-9H,1-3H3
InChIKey NZUIFJUDFWPJPN-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms ZINC01085072 ST028789 1,3-Benzenedicarboxylic acid, 5-(4-(methoxycarbonyl)-2-nitrophenoxy)-, dimethyl ester
Wiley ID SIAL_13CNMR_007970