5-(4-methylphenyl)-3-[4-(octyloxy)phenyl]-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione

SpectraBase Compound ID	KOoscxr7Zoc
InChI	InChI=1S/C32H36N2O4/c1-3-4-5-6-7-11-22-37-27-20-16-24(17-21-27)29-28-30(38-34(29)26-12-9-8-10-13-26)32(36)33(31(28)35)25-18-14-23(2)15-19-25/h8-10,12-21,28-30H,3-7,11,22H2,1-2H3
InChIKey	CEDHVXMBSQRJTQ-UHFFFAOYSA-N Google Search
Mol Weight	512.7 g/mol
Molecular Formula	C32H36N2O4
Exact Mass	512.267508 g/mol

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SpectraBase Spectrum ID	JigYO1bIWpW
Name	5-(4-methylphenyl)-3-[4-(octyloxy)phenyl]-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione
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/C32H36N2O4/c1-3-4-5-6-7-11-22-37-27-20-16-24(17-21-27)29-28-30(38-34(29)26-12-9-8-10-13-26)32(36)33(31(28)35)25-18-14-23(2)15-19-25/h8-10,12-21,28-30H,3-7,11,22H2,1-2H3
InChIKey	CEDHVXMBSQRJTQ-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_5888
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: C94645; Labnumber: VLM1991-2; SBI_ID: SBI-005891
Temperature	308 °C