5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furoic acid

SpectraBase Compound ID	IgMLfJ2ahge
InChI	InChI=1S/C9H6BrN3O5/c10-6-4-12(11-8(6)13(16)17)3-5-1-2-7(18-5)9(14)15/h1-2,4H,3H2,(H,14,15)
InChIKey	RLWQKLOXFLKEPV-UHFFFAOYSA-N Google Search
Mol Weight	316.07 g/mol
Molecular Formula	C9H6BrN3O5
Exact Mass	314.949083 g/mol

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SpectraBase Spectrum ID	Flo4jD2dlMm
Name	5-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-2-furoic acid
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/C9H6BrN3O5/c10-6-4-12(11-8(6)13(16)17)3-5-1-2-7(18-5)9(14)15/h1-2,4H,3H2,(H,14,15)
InChIKey	RLWQKLOXFLKEPV-UHFFFAOYSA-N
NMR Offset	16.0772
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_1550
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/1011988; Labnumber: ACI0350; UZI_ID: UZI-001552
Temperature	308 °C