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3-{[3,5-bis(isopropoxycarbonyl)anilino]carbonyl}-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
SpectraBase Compound ID Kv7GhN6FiKS
InChI InChI=1S/C22H25NO8/c1-10(2)29-21(27)12-7-13(22(28)30-11(3)4)9-14(8-12)23-19(24)17-15-5-6-16(31-15)18(17)20(25)26/h5-11,15-18H,1-4H3,(H,23,24)(H,25,26)/t15-,16+,17+,18+/m0/s1
InChIKey GZECYWSMZIKHJK-BSDSXHPESA-N
Mol Weight 431.44 g/mol
Molecular Formula C22H25NO8
Exact Mass 431.158017 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BewLQE5yoYG
Name 3-{[3,5-bis(isopropoxycarbonyl)anilino]carbonyl}-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H25NO8/c1-10(2)29-21(27)12-7-13(22(28)30-11(3)4)9-14(8-12)23-19(24)17-15-5-6-16(31-15)18(17)20(25)26/h5-11,15-18H,1-4H3,(H,23,24)(H,25,26)/t15-,16+,17+,18+/m0/s1
InChIKey GZECYWSMZIKHJK-BSDSXHPESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_16031
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1007568; Labnumber: NSB-0100635; UZI_ID: UZI-016035
Temperature 318 °C