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ethanone, 1-[1-(4-nitrophenyl)-4-(2-thienylcarbonyl)-1H-pyrazol-3-yl]-
SpectraBase Compound ID JsKcjZIJET0
InChI InChI=1S/C16H11N3O4S/c1-10(20)15-13(16(21)14-3-2-8-24-14)9-18(17-15)11-4-6-12(7-5-11)19(22)23/h2-9H,1H3
InChIKey RGBRYXSSNGSIMJ-UHFFFAOYSA-N
Mol Weight 341.34 g/mol
Molecular Formula C16H11N3O4S
Exact Mass 341.047027 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 81dgoty80F
Name ethanone, 1-[1-(4-nitrophenyl)-4-(2-thienylcarbonyl)-1H-pyrazol-3-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 341.047027016 u
Formula C16H11N3O4S
InChI InChI=1S/C16H11N3O4S/c1-10(20)15-13(16(21)14-3-2-8-24-14)9-18(17-15)11-4-6-12(7-5-11)19(22)23/h2-9H,1H3
InChIKey RGBRYXSSNGSIMJ-UHFFFAOYSA-N
Molecular Weight 341.341 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10096
Solvent DMSO-d6
Source Vendor ID: NMR/9226102; Lab Info: EGYP; Lab Number: EGYP-0000071