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5-isoxazolecarboxamide, N-[1-[(2,6-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl]-4,5-dihydro-3-(2-methoxyphenyl)-
SpectraBase Compound ID 72KAgH5aAv2
InChI InChI=1S/C20H17Cl2N5O3/c1-29-17-8-3-2-5-12(17)16-9-18(30-26-16)19(28)24-20-23-11-27(25-20)10-13-14(21)6-4-7-15(13)22/h2-8,11,18H,9-10H2,1H3,(H,24,25,28)
InChIKey KTZBKXZQOOEOCK-UHFFFAOYSA-N
Mol Weight 446.29 g/mol
Molecular Formula C20H17Cl2N5O3
Exact Mass 445.070845 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 28Ugl72g5dG
Name 5-isoxazolecarboxamide, N-[1-[(2,6-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl]-4,5-dihydro-3-(2-methoxyphenyl)-
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/C20H17Cl2N5O3/c1-29-17-8-3-2-5-12(17)16-9-18(30-26-16)19(28)24-20-23-11-27(25-20)10-13-14(21)6-4-7-15(13)22/h2-8,11,18H,9-10H2,1H3,(H,24,25,28)
InChIKey KTZBKXZQOOEOCK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21495
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: 2180180; UZI_ID: UZI-021503
Temperature 308 °C