m-nitrobenzenesulfonic acid, 2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl ester

SpectraBase Compound ID	9i6kpsRpZ5b
InChI	InChI=1S/C22H29NO6S/c1-21(2,3)16-22(4,5)17-9-11-19(12-10-17)28-13-14-29-30(26,27)20-8-6-7-18(15-20)23(24)25/h6-12,15H,13-14,16H2,1-5H3
InChIKey	JAILCIAACZEEST-UHFFFAOYSA-N Google Search
Mol Weight	435.54 g/mol
Molecular Formula	C22H29NO6S
Exact Mass	435.171559 g/mol

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SpectraBase Spectrum ID	56YKq8Hyi3d
Name	2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl 3-nitrobenzenesulfonate
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/C22H29NO6S/c1-21(2,3)16-22(4,5)17-9-11-19(12-10-17)28-13-14-29-30(26,27)20-8-6-7-18(15-20)23(24)25/h6-12,15H,13-14,16H2,1-5H3
InChIKey	JAILCIAACZEEST-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_17284
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: 987/00005278; Labnumber: 987/00005278218864; VK_ID: VK-017289
Temperature	318 °C