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ethyl 4-({(2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID Hks8IIGMVDR
InChI InChI=1S/C18H18BrN3O5/c1-4-25-18(24)16-9(2)15(10(3)21-16)17(23)22-20-7-11-5-13-14(6-12(11)19)27-8-26-13/h5-7,21H,4,8H2,1-3H3,(H,22,23)/b20-7+
InChIKey QJZURVHVCKAIHU-IFRROFPPSA-N
Mol Weight 436.26 g/mol
Molecular Formula C18H18BrN3O5
Exact Mass 435.042984 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IbFYf4jZ9Dd
Name ethyl 4-({(2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
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/C18H18BrN3O5/c1-4-25-18(24)16-9(2)15(10(3)21-16)17(23)22-20-7-11-5-13-14(6-12(11)19)27-8-26-13/h5-7,21H,4,8H2,1-3H3,(H,22,23)/b20-7+
InChIKey QJZURVHVCKAIHU-IFRROFPPSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1599
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/8024840; UBI_ID: UBI-001600
Synonyms ethyl 4-({2-[(6-bromo-1,3-benzodioxol-5-yl)methylene]hydrazino}carbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Temperature 308 °C