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2-propenoic acid, 2-cyano-3-[1-(3-nitrophenyl)-1H-pyrrol-2-yl]-, ethylester, (2Z)-
SpectraBase Compound ID 4KikTmspUDH
InChI InChI=1S/C16H13N3O4/c1-2-23-16(20)12(11-17)9-13-7-4-8-18(13)14-5-3-6-15(10-14)19(21)22/h3-10H,2H2,1H3/b12-9-
InChIKey JKZLPBUJLIGRGE-XFXZXTDPSA-N
Mol Weight 311.3 g/mol
Molecular Formula C16H13N3O4
Exact Mass 311.090606 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9dP2CEHCOpi
Name 2-propenoic acid, 2-cyano-3-[1-(3-nitrophenyl)-1H-pyrrol-2-yl]-, ethylester, (2Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.090605907 u
Formula C16H13N3O4
InChI InChI=1S/C16H13N3O4/c1-2-23-16(20)12(11-17)9-13-7-4-8-18(13)14-5-3-6-15(10-14)19(21)22/h3-10H,2H2,1H3/b12-9-
InChIKey JKZLPBUJLIGRGE-XFXZXTDPSA-N
Molecular Weight 311.297 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10372
Solvent DMSO-d6
Source Vendor ID: NMR/9234631; Lab Info: LP; Lab Number: LP-1300017