pyrrolo[3,4-c]pyrazole-3-carboxylic acid, 5-(3-bromophenyl)-1,3a,4,5,6,6a-hexahydro-4,6-dioxo-, ethyl ester

SpectraBase Compound ID	94h3UVGuTup
InChI	InChI=1S/C14H12BrN3O4/c1-2-22-14(21)11-9-10(16-17-11)13(20)18(12(9)19)8-5-3-4-7(15)6-8/h3-6,9-10,16H,2H2,1H3
InChIKey	JPXLAETUEQVNIJ-UHFFFAOYSA-N Google Search
Mol Weight	366.17 g/mol
Molecular Formula	C14H12BrN3O4
Exact Mass	365.001119 g/mol

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SpectraBase Spectrum ID	JbunzZ9gxpB
Name	pyrrolo[3,4-c]pyrazole-3-carboxylic acid, 5-(3-bromophenyl)-1,3a,4,5,6,6a-hexahydro-4,6-dioxo-, ethyl ester
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/C14H12BrN3O4/c1-2-22-14(21)11-9-10(16-17-11)13(20)18(12(9)19)8-5-3-4-7(15)6-8/h3-6,9-10,16H,2H2,1H3
InChIKey	JPXLAETUEQVNIJ-UHFFFAOYSA-N
NMR Offset	17.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_2684
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: NMR/10218145