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4-{(Z)-[4-(methoxycarbonyl)-1,5-dimethyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic acid
SpectraBase Compound ID FSkSeRV8YPg
InChI InChI=1S/C16H15NO5/c1-9-13(16(21)22-3)12(14(18)17(9)2)8-10-4-6-11(7-5-10)15(19)20/h4-8H,1-3H3,(H,19,20)/b12-8-
InChIKey BAIMRTHCUUFMIM-WQLSENKSSA-N
Mol Weight 301.3 g/mol
Molecular Formula C16H15NO5
Exact Mass 301.095023 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 42BZv8blkGd
Name 4-{(Z)-[4-(methoxycarbonyl)-1,5-dimethyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic 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/C16H15NO5/c1-9-13(16(21)22-3)12(14(18)17(9)2)8-10-4-6-11(7-5-10)15(19)20/h4-8H,1-3H3,(H,19,20)/b12-8-
InChIKey BAIMRTHCUUFMIM-WQLSENKSSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15754
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: C75143; Labnumber: SPDEM-3895; SBI_ID: SBI-015757
Synonyms 4-{[4-(methoxycarbonyl)-1,5-dimethyl-2-oxo-1,2-dihydro-3H-pyrrol-3-ylidene]methyl}benzoic acid
Temperature 318 °C