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2-[3-(3-Butyl-2-quinoxalinyl)-2-thienyl]3-[2-[3-(3-thienyl)-2-quinoxalinyl]-3-thienyl]quinoxaline
SpectraBase Compound ID 9EOT9nafhRq
InChI InChI=1S/C40H28N6S3/c1-2-3-10-33-35(43-28-12-5-4-11-27(28)41-33)25-18-21-48-39(25)38-36(44-30-14-7-9-16-32(30)46-38)26-19-22-49-40(26)37-34(24-17-20-47-23-24)42-29-13-6-8-15-31(29)45-37/h4-9,11-23H,2-3,10H2,1H3
InChIKey PUDGZCBEAWPWSI-UHFFFAOYSA-N
Mol Weight 688.9 g/mol
Molecular Formula C40H28N6S3
Exact Mass 688.153758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zsB2mOlwlI
Name 2-[3-(3-Butyl-2-quinoxalinyl)-2-thienyl]3-[2-[3-(3-thienyl)-2-quinoxalinyl]-3-thienyl]quinoxaline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H28N6S3
InChI InChI=1S/C40H28N6S3/c1-2-3-10-33-35(43-28-12-5-4-11-27(28)41-33)25-18-21-48-39(25)38-36(44-30-14-7-9-16-32(30)46-38)26-19-22-49-40(26)37-34(24-17-20-47-23-24)42-29-13-6-8-15-31(29)45-37/h4-9,11-23H,2-3,10H2,1H3
InChIKey PUDGZCBEAWPWSI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19821150516
Molecular Weight 688.886 g/mol
SMILES c1(nc2c(nc1-c1ccsc1)cccc2)-c1c(-c2nc3ccccc3nc2-c2sccc2-c2nc3c(nc2CCCC)cccc3)ccs1
SPLASH splash10-000x-1000009000-87e30bb85e21f8695253
Source of Spectrum K-115-1832-8
Synonyms 2-Butyl-3-(2-(3-(2-(3-(thiophen-3-yl)quinoxalin-2-yl)thiophen-3-yl)quinoxalin-2-yl)thiophen-3-yl)quinoxaline
Wiley ID 1791968