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N-(6-acetyl-1,3-benzodioxol-5-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
SpectraBase Compound ID AfmrYehE6gF
InChI InChI=1S/C14H12IN3O4/c1-7(19)8-3-11-12(22-6-21-11)4-10(8)16-14(20)13-9(15)5-18(2)17-13/h3-5H,6H2,1-2H3,(H,16,20)
InChIKey UBCPBVKZKDWQSF-UHFFFAOYSA-N
Mol Weight 413.17 g/mol
Molecular Formula C14H12IN3O4
Exact Mass 412.987251 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KV43zvoBxpn
Name N-(6-acetyl-1,3-benzodioxol-5-yl)-4-iodo-1-methyl-1H-pyrazole-3-carboxamide
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/C14H12IN3O4/c1-7(19)8-3-11-12(22-6-21-11)4-10(8)16-14(20)13-9(15)5-18(2)17-13/h3-5H,6H2,1-2H3,(H,16,20)
InChIKey UBCPBVKZKDWQSF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5105
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/8148529; UBI_ID: UBI-005107
Temperature 318 °C