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2,6-Bis[5-(4,5,6,7-tetrahydrobenzo[b]thiophene-2-yl)-2-thienyl]spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,9'-fluorene]
SpectraBase Compound ID 6X9QpeC1hTT
InChI InChI=1S/C45H32S6/c1-7-15-33-25(9-1)21-39(46-33)35-17-19-37(48-35)41-23-31-43(50-41)44-32(45(31)29-13-5-3-11-27(29)28-12-4-6-14-30(28)45)24-42(51-44)38-20-18-36(49-38)40-22-26-10-2-8-16-34(26)47-40/h3-6,11-14,17-24H,1-2,7-10,15-16H2
InChIKey YBKCQXDMJIQLRK-UHFFFAOYSA-N
Mol Weight 765.1 g/mol
Molecular Formula C45H32S6
Exact Mass 764.082828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISO4PRTA7IR
Name 2,6-Bis[5-(4,5,6,7-tetrahydrobenzo[b]thiophene-2-yl)-2-thienyl]spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,9'-fluorene]
Alternate Name(s) 4',10'-bis[5-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)thiophen-2-yl]-3',11'-dithiaspiro[fluorene-9,7'-tricyclo[6.3.0.0(2,6)]undecane]-1'(8'),2'(6'),4',9'-tetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C45H32S6
InChI InChI=1S/C45H32S6/c1-7-15-33-25(9-1)21-39(46-33)35-17-19-37(48-35)41-23-31-43(50-41)44-32(45(31)29-13-5-3-11-27(29)28-12-4-6-14-30(28)45)24-42(51-44)38-20-18-36(49-38)40-22-26-10-2-8-16-34(26)47-40/h3-6,11-14,17-24H,1-2,7-10,15-16H2
InChIKey YBKCQXDMJIQLRK-UHFFFAOYSA-N
Molecular Weight 765.111 g/mol
SMILES C12(c3c(sc(c3)-c3sc(-c4sc5CCCCc5c4)cc3)-c3c1cc(-c1sc(-c4sc5CCCCc5c4)cc1)s3)c1c(cccc1)-c1c2cccc1
SPLASH splash10-02t9-0000000900-f6dbeddec9473fa0f1e0
Source of Spectrum K-2001-752-5
Wiley ID 1578738