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3-[3-(2,2-dicyanovinyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid
SpectraBase Compound ID CFo75RCncKK
InChI InChI=1S/C17H13N3O2/c1-11-6-15(7-13(9-18)10-19)12(2)20(11)16-5-3-4-14(8-16)17(21)22/h3-8H,1-2H3,(H,21,22)
InChIKey GNATXJZNPMOLEL-UHFFFAOYSA-N
Mol Weight 291.31 g/mol
Molecular Formula C17H13N3O2
Exact Mass 291.100777 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3sUl0PF0x4Q
Name 3-[3-(2,2-dicyanovinyl)-2,5-dimethyl-1H-pyrrol-1-yl]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/C17H13N3O2/c1-11-6-15(7-13(9-18)10-19)12(2)20(11)16-5-3-4-14(8-16)17(21)22/h3-8H,1-2H3,(H,21,22)
InChIKey GNATXJZNPMOLEL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9393
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: 133345; Labnumber: AREF2K-0387; VK_ID: VK-009397
Temperature 308 °C