Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)

Chemical Information

molecular Image
InChI InChI=1S/C108H108S21Si8/c1-130(2,3)95-47-39-79(116-95)91-57-63(105(126-91)85-43-51-99(120-85)134(13,14)15)69-27-33-77(111-69)89-55-61(103(124-89)83-37-29-71(113-83)65-59-93(81-41-49-97(118-81)132(7,8)9)128-107(65)87-45-53-101(122-87)136(19,20)21)67-25-31-73(109-67)75-35-36-76(115-75)74-32-26-68(110-74)62-56-90(78-34-28-70(112-78)64-58-92(80-40-48-96(117-80)131(4,5)6)127-106(64)86-44-52-100(121-86)135(16,17)18)125-104(62)84-38-30-72(114-84)66-60-94(82-42-50-98(119-82)133(10,11)12)129-108(66)88-46-54-102(123-88)137(22,23)24/h25-60H,1-24H3
SMILES C[Si](c1ccc(s1)c1sc(cc1c1ccc(s1)c1sc(cc1c1ccc(s1)c1ccc(s1)c1ccc(s1)c1cc(sc1c1ccc(s1)c1cc(sc1c1ccc(s1)[Si](C)(C)C)c1ccc(s1)[Si](C)(C)C)c1ccc(s1)c1cc(sc1c1ccc(s1)[Si](C)(C)C)c1ccc(s1)[Si](C)(C)C)c1ccc(s1)c1cc(sc1c1ccc(s1)[Si](C)(C)C)c1ccc(s1)[Si](C)(C)C)c1ccc(s1)[Si](C)(C)C)(C)C
InChI Key VLLPLMLJCXUBKT-UHFFFAOYSA-N
Exact Mass 2304.062 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VLLPLMLJCXUBKT-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/VLLPLMLJCXUBKT-UHFFFAOYSA-N/CHMO0001150
Version
Author Peter Bäuerle
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-08-28
Related Molecule
  • [5-[3-[5-[3-[5-[5-[5-[2,5-bis[5-[2,5-bis(5-trimethylsilylthiophen-2-yl)thiophen-3-yl]thiophen-2-yl]thiophen-3-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-5-[5-[2,5-bis(5-trimethylsilylthiophen-2-yl)thiophen-3-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-5-(5-trimethylsilylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-trimethylsilane
    • Field Value
    Measurement Technique 1H–1H correlation spectroscopy
    Measurement Variables
    title : X25862

    date : 20250312

    starting time : 20.35 h

    label : SVS-3868

    id : 358628

    Solvent : chloroform-D1 (CDCl3)

    temperature : 300.0 K

    PULPROG : cosygpppqf

    number of scans : 1 scans

    instrument : spect

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.