3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(4-chlorophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, (3aS,6aR)-

SpectraBase Compound ID	JCQMULfl7Nu
InChI	InChI=1S/C17H15ClN4O3/c1-8-12(9(2)21(3)19-8)14-13-15(25-20-14)17(24)22(16(13)23)11-6-4-10(18)5-7-11/h4-7,13,15H,1-3H3
InChIKey	OYFPGHGURPUWRR-UHFFFAOYSA-N Google Search
Mol Weight	358.79 g/mol
Molecular Formula	C17H15ClN4O3
Exact Mass	358.083268 g/mol

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SpectraBase Spectrum ID	KHxRW4Ocye3
Name	3aH-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-(4-chlorophenyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)-, (3aS,6aR)-
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/C17H15ClN4O3/c1-8-12(9(2)21(3)19-8)14-13-15(25-20-14)17(24)22(16(13)23)11-6-4-10(18)5-7-11/h4-7,13,15H,1-3H3
InChIKey	OYFPGHGURPUWRR-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_5821
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: F26337; Labnumber: NNA-V-25936