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5-Bromo-5"-heptadecyl-2,2':5',2"-terthiophene

View entire compound with spectra: 1 MS (GC)

5-Bromo-5"-heptadecyl-2,2':5',2"-terthiophene
SpectraBase Compound ID 9aA0PullvuS
InChI InChI=1S/C29H41BrS3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-18-19-25(31-24)26-20-21-27(32-26)28-22-23-29(30)33-28/h18-23H,2-17H2,1H3
InChIKey IQBCULBMMDOIEH-UHFFFAOYSA-N
Mol Weight 565.7 g/mol
Molecular Formula C29H41BrS3
Exact Mass 564.155378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88hhbBIbqe
Name 5-Bromo-5"-heptadecyl-2,2':5',2"-terthiophene
Alternate Name(s) 2-(5-bromothiophen-2-yl)-5-(5-heptadecylthiophen-2-yl)thiophene 5-Bromo-5''-heptadecyl-2,2':5',2''-terthiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H41BrS3
InChI InChI=1S/C29H41BrS3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-18-19-25(31-24)26-20-21-27(32-26)28-22-23-29(30)33-28/h18-23H,2-17H2,1H3
InChIKey IQBCULBMMDOIEH-UHFFFAOYSA-N
Molecular Weight 565.731 g/mol
SMILES c1(sc(cc1)-c1sc(Br)cc1)-c1sc(CCCCCCCCCCCCCCCCC)cc1
SPLASH splash10-0wmi-0415190000-1bc949e81f6d9f604638
Source of Spectrum F-51-2238-17
Wiley ID 791045