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1-(3-Dodecyl-2-thienyl)-3-(2-thienyl)benzo[c]thiophene-5-carboxylate
SpectraBase Compound ID 8l7RoQmfMoL
InChI InChI=1S/C29H34OS3/c1-2-3-4-5-6-7-8-9-10-11-14-22-19-20-31-27(22)29-25-16-13-12-15-24(25)28(33-29)26-18-17-23(21-30)32-26/h12-13,15-21H,2-11,14H2,1H3
InChIKey VMMQOCXZNLTHSG-UHFFFAOYSA-N
Mol Weight 494.8 g/mol
Molecular Formula C29H34OS3
Exact Mass 494.177179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7IjgtmrDCyx
Name 1-(3-Dodecyl-2-thienyl)-3-(2-thienyl)benzo[c]thiophene-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H34OS3
InChI InChI=1S/C29H34OS3/c1-2-3-4-5-6-7-8-9-10-11-14-22-19-20-31-27(22)29-25-16-13-12-15-24(25)28(33-29)26-18-17-23(21-30)32-26/h12-13,15-21H,2-11,14H2,1H3
InChIKey VMMQOCXZNLTHSG-UHFFFAOYSA-N
Molecular Weight 494.770 g/mol
SMILES c1(sc(-c2sc(C=O)cc2)c2c1cccc2)-c1c(ccs1)CCCCCCCCCCCC
SPLASH splash10-002f-0063900000-5fb48a613110a183e41a
Source of Spectrum J-63-3110-10
Synonyms 5-[3-(3-Dodecyl-thiophen-2-yl)-benzo[c]thiophen-1-yl]-thiophene-2-carbaldehyde 5-[3-(3-dodecyl-2-thiophenyl)-2-benzothiophen-1-yl]-2-thiophenecarboxaldehyde 5-[3-(3-dodecyl-2-thienyl)-2-benzothiophen-1-yl]thiophene-2-carbaldehyde 5-[3-(3-dodecylthiophen-2-yl)-2-benzothiophen-1-yl]thiophene-2-carbaldehyde
Wiley ID 1397951