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2-{5-[(hexadecyloxy)methyl]thiophen-2-yl}-5-(thiophen-2-yl)thiophene
SpectraBase Compound ID 3Cl29N669MC
InChI InChI=1S/C29H42OS3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-30-24-25-18-19-28(32-25)29-21-20-27(33-29)26-17-16-23-31-26/h16-21,23H,2-15,22,24H2,1H3
InChIKey JPBMJAODBIKKLH-UHFFFAOYSA-N
Mol Weight 502.8 g/mol
Molecular Formula C29H42OS3
Exact Mass 502.239779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18v4bO9KbMW
Name 2-{5-[(hexadecyloxy)methyl]thiophen-2-yl}-5-(thiophen-2-yl)thiophene
Alternate Name(s) 5-Hexadecyloxy-2,2':5',2''-terthiophene 5-Hexadecyloxymethyl-[2,2':5',2'']-terthiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H42OS3
InChI InChI=1S/C29H42OS3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-30-24-25-18-19-28(32-25)29-21-20-27(33-29)26-17-16-23-31-26/h16-21,23H,2-15,22,24H2,1H3
InChIKey JPBMJAODBIKKLH-UHFFFAOYSA-N
Molecular Weight 502.834 g/mol
SMILES c1(sc(cc1)-c1sccc1)-c1sc(COCCCCCCCCCCCCCCCC)cc1
SPLASH splash10-0ik9-0290050000-518606b5b2d0741afff5
Source of Spectrum F-51-2237-5
Wiley ID 791050