2,6-ditert-butyl-4-[4-(methoxycarbonyl)phenyl]thiopyrylium perchlorate

SpectraBase Compound ID	BEksesb157i
InChI	InChI=1S/C21H27O2S.ClHO4/c1-20(2,3)17-12-16(13-18(24-17)21(4,5)6)14-8-10-15(11-9-14)19(22)23-7;2-1(3,4)5/h8-13H,1-7H3;(H,2,3,4,5)/q+1;/p-1
InChIKey	BCBQSKUCVBVQAK-UHFFFAOYSA-M Google Search
Mol Weight	442.95 g/mol
Molecular Formula	C21H27ClO6S
Exact Mass	442.121687 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	5yxM0JahAzh
Name	2,6-ditert-butyl-4-[4-(methoxycarbonyl)phenyl]thiopyrylium perchlorate
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/C21H27O2S.ClHO4/c1-20(2,3)17-12-16(13-18(24-17)21(4,5)6)14-8-10-15(11-9-14)19(22)23-7;2-1(3,4)5/h8-13H,1-7H3;(H,2,3,4,5)/q+1;/p-1
InChIKey	BCBQSKUCVBVQAK-UHFFFAOYSA-M
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_16368
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: 987/00003682; Labnumber: 987/00003682218844; VK_ID: VK-016373
Temperature	308 °C