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2,6-ditert-butyl-4-[5-(2,6-ditert-butyl-4-thiopyryliumyl)-2-thienyl]thiopyrylium ditetrafluoroborate
SpectraBase Compound ID 9zjv76QlPYB
InChI InChI=1S/C30H42S3.2BF4/c1-27(2,3)23-15-19(16-24(32-23)28(4,5)6)21-13-14-22(31-21)20-17-25(29(7,8)9)33-26(18-20)30(10,11)12;2*2-1(3,4)5/h13-18H,1-12H3;;/q+2;2*-1
InChIKey KXHWXVDTXTZKJC-UHFFFAOYSA-N
Mol Weight 672.5 g/mol
Molecular Formula C30H42B2F8S3
Exact Mass 672.250701 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LjGxfLjSXH0
Name 2,6-ditert-butyl-4-[5-(2,6-ditert-butyl-4-thiopyryliumyl)-2-thienyl]thiopyrylium ditetrafluoroborate
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/C30H42S3.2BF4/c1-27(2,3)23-15-19(16-24(32-23)28(4,5)6)21-13-14-22(31-21)20-17-25(29(7,8)9)33-26(18-20)30(10,11)12;2*2-1(3,4)5/h13-18H,1-12H3;;/q+2;2*-1
InChIKey KXHWXVDTXTZKJC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16383
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: 987/00003713; Labnumber: 987/00003713218845; VK_ID: VK-016388
Temperature 318 °C