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2-{3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(1-ethyl-4-nitro-1H-pyrazol-3-yl)carbonyl]-4,5-dihydro-1H-pyrazol-5-yl}phenol
SpectraBase Compound ID 28Qv2Kn2oDF
InChI InChI=1S/C23H21N5O6/c1-2-26-13-18(28(31)32)22(25-26)23(30)27-17(15-5-3-4-6-19(15)29)12-16(24-27)14-7-8-20-21(11-14)34-10-9-33-20/h3-8,11,13,17,29H,2,9-10,12H2,1H3
InChIKey BUZJSACZLMNPKA-UHFFFAOYSA-N
Mol Weight 463.45 g/mol
Molecular Formula C23H21N5O6
Exact Mass 463.149183 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7QfB8icgk2S
Name 2-{3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(1-ethyl-4-nitro-1H-pyrazol-3-yl)carbonyl]-4,5-dihydro-1H-pyrazol-5-yl}phenol
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/C23H21N5O6/c1-2-26-13-18(28(31)32)22(25-26)23(30)27-17(15-5-3-4-6-19(15)29)12-16(24-27)14-7-8-20-21(11-14)34-10-9-33-20/h3-8,11,13,17,29H,2,9-10,12H2,1H3
InChIKey BUZJSACZLMNPKA-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9029
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: UZI/1265429; Labnumber: Gbb0206; UZI_ID: UZI-009031
Temperature 308 °C