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2,4-hexadienoic acid, 2-cyano-5-[[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]amino]-3-methyl-, (2E,4E)-
SpectraBase Compound ID 1iceq9jq6wl
InChI InChI=1S/C17H15N3O4/c1-10(14(8-18)17(23)24)7-11(2)19-9-20-15(21)12-5-3-4-6-13(12)16(20)22/h3-7,19H,9H2,1-2H3,(H,23,24)/b11-7+,14-10+
InChIKey SHXODJATFBMBOT-MYUCQOFCSA-N
Mol Weight 325.32 g/mol
Molecular Formula C17H15N3O4
Exact Mass 325.106256 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F61gUVjZvkF
Name 2,4-hexadienoic acid, 2-cyano-5-[[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)methyl]amino]-3-methyl-, (2E,4E)-
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/C17H15N3O4/c1-10(14(8-18)17(23)24)7-11(2)19-9-20-15(21)12-5-3-4-6-13(12)16(20)22/h3-7,19H,9H2,1-2H3,(H,23,24)/b11-7+,14-10+
InChIKey SHXODJATFBMBOT-MYUCQOFCSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_4001
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: NMR/17241199; Labnumber: 21c5006