N-[1-(2-chloro-6-fluorobenzyl)-1H-1,2,4-triazol-3-yl]-5-phenyl-3-isoxazolecarboxamide

SpectraBase Compound ID	LjDFjO6n5JT
InChI	InChI=1S/C19H13ClFN5O2/c20-14-7-4-8-15(21)13(14)10-26-11-22-19(24-26)23-18(27)16-9-17(28-25-16)12-5-2-1-3-6-12/h1-9,11H,10H2,(H,23,24,27)
InChIKey	XNISQLDVGYASNR-UHFFFAOYSA-N Google Search
Mol Weight	397.8 g/mol
Molecular Formula	C19H13ClFN5O2
Exact Mass	397.074181 g/mol

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SpectraBase Spectrum ID	4Vms1xhHXhN
Name	N-[1-(2-chloro-6-fluorobenzyl)-1H-1,2,4-triazol-3-yl]-5-phenyl-3-isoxazolecarboxamide
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/C19H13ClFN5O2/c20-14-7-4-8-15(21)13(14)10-26-11-22-19(24-26)23-18(27)16-9-17(28-25-16)12-5-2-1-3-6-12/h1-9,11H,10H2,(H,23,24,27)
InChIKey	XNISQLDVGYASNR-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_29870
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: 1344354; SBI_ID: SBI-029874
Temperature	308 °C