(2Z)-2-butenedioic acid compound with 1-[4-[2-hydroxy-3-(isopropylamino)propoxy]-3-(propoxymethyl)phenyl]ethanone (1:1)

SpectraBase Compound ID	ImZYIxZVipu
InChI	InChI=1S/C18H29NO4.C4H4O4/c1-5-8-22-11-16-9-15(14(4)20)6-7-18(16)23-12-17(21)10-19-13(2)3;5-3(6)1-2-4(7)8/h6-7,9,13,17,19,21H,5,8,10-12H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey	OMQSPGOFINBTAW-BTJKTKAUSA-N Google Search
Mol Weight	439.5 g/mol
Molecular Formula	C22H33NO8
Exact Mass	439.220617 g/mol

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SpectraBase Spectrum ID	EzmwAkxN5Ep
Name	(2Z)-2-butenedioic acid compound with 1-[4-[2-hydroxy-3-(isopropylamino)propoxy]-3-(propoxymethyl)phenyl]ethanone (1:1)
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/C18H29NO4.C4H4O4/c1-5-8-22-11-16-9-15(14(4)20)6-7-18(16)23-12-17(21)10-19-13(2)3;5-3(6)1-2-4(7)8/h6-7,9,13,17,19,21H,5,8,10-12H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
InChIKey	OMQSPGOFINBTAW-BTJKTKAUSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_15073
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: 987/00001316; Labnumber: 987/00001316218815; VK_ID: VK-015078
Synonyms	2-butenedioic acid compound with 1-[4-[2-hydroxy-3-(isopropylamino)propoxy]-3-(propoxymethyl)phenyl]ethanone (1:1)
Temperature	308 °C