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2-{3-Pentyl-5-[(E)-2-phenylvinyl]thieno[3,2-b]thiophen-2-yl)-1,3-benzothiazole
SpectraBase Compound ID LJfnBYCSvbl
InChI InChI=1S/C26H23NS3/c1-2-3-5-12-20-24-23(17-19(28-24)16-15-18-10-6-4-7-11-18)29-25(20)26-27-21-13-8-9-14-22(21)30-26/h4,6-11,13-17H,2-3,5,12H2,1H3/b16-15+
InChIKey HVJWIBQTGLEFNB-FOCLMDBBSA-N
Mol Weight 445.66 g/mol
Molecular Formula C26H23NS3
Exact Mass 445.099263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HV7DrumZlYW
Name 2-{3-Pentyl-5-[(E)-2-phenylvinyl]thieno[3,2-b]thiophen-2-yl)-1,3-benzothiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23NS3
InChI InChI=1S/C26H23NS3/c1-2-3-5-12-20-24-23(17-19(28-24)16-15-18-10-6-4-7-11-18)29-25(20)26-27-21-13-8-9-14-22(21)30-26/h4,6-11,13-17H,2-3,5,12H2,1H3/b16-15+
InChIKey HVJWIBQTGLEFNB-FOCLMDBBSA-N
Molecular Weight 445.657 g/mol
SMILES c1(-c2nc3ccccc3s2)c(c2sc(cc2s1)\C=C\c1ccccc1)CCCCC
SPLASH splash10-0f6y-5000900000-84f06a4d7be028decc48
Source of Spectrum HC-47-1451-4a
Synonyms (E)-2-(3-pentyl-5-styrylthieno[3,2-b]thiophen-2-yl)benzo[d]thiazole
Wiley ID 1739085