octanoic acid, 4-[(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)methyl]-2-methoxyphenyl ester

SpectraBase Compound ID	H2jIC98NwPh
InChI	InChI=1S/C25H26O5/c1-3-4-5-6-7-12-23(26)30-21-14-13-17(16-22(21)29-2)15-20-24(27)18-10-8-9-11-19(18)25(20)28/h8-11,13-16H,3-7,12H2,1-2H3
InChIKey	LIYOZFYNUPKEKJ-UHFFFAOYSA-N Google Search
Mol Weight	406.48 g/mol
Molecular Formula	C25H26O5
Exact Mass	406.178024 g/mol

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SpectraBase Spectrum ID	1W9ft69doCt
Name	octanoic acid, 4-[(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)methyl]-2-methoxyphenyl 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/C25H26O5/c1-3-4-5-6-7-12-23(26)30-21-14-13-17(16-22(21)29-2)15-20-24(27)18-10-8-9-11-19(18)25(20)28/h8-11,13-16H,3-7,12H2,1-2H3
InChIKey	LIYOZFYNUPKEKJ-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_3791
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/11311367; Labnumber: KOZ-0000018