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rac-Ethylenbis-(4,5,6,7,8,9-hexahydrocyclopenta[8]annulen-1-yl)titanium(IV)chloride
SpectraBase Compound ID CSGMkungn3m
InChI InChI=1S/C24H32.2ClH.Ti/c1-3-7-11-23-19(9-5-1)13-15-21(23)17-18-22-16-14-20-10-6-2-4-8-12-24(20)22;;;/h13-16H,1-12,17-18H2;2*1H;/q;;;+2/p-2
InChIKey VMCAREIMICFYCI-UHFFFAOYSA-L
Mol Weight 435.26 g/mol
Molecular Formula C24H28Cl2Ti
Exact Mass 434.104747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L6OelZfOSA4
Name rac-Ethylenbis-(4,5,6,7,8,9-hexahydrocyclopenta[8]annulen-1-yl)titanium(IV)chloride
Appearance Red solid
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Exact Mass 434.104747202 u
Formula C24H28Cl2Ti
InChI InChI=1S/C24H32.2ClH.Ti/c1-3-7-11-23-19(9-5-1)13-15-21(23)17-18-22-16-14-20-10-6-2-4-8-12-24(20)22;;;/h13-16H,1-12,17-18H2;2*1H;/q;;;+2/p-2
InChIKey VMCAREIMICFYCI-UHFFFAOYSA-L
Instrument Name Thermo Finnigan TSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201804497
Molecular Weight 435.261 g/mol
Quality 54
Reported Formula C24H32Cl2Ti
SMILES [C]1[C]([C]2[C]([C]1)CCCCCC2)CC[C]1[C][C][C]2[C]1CCCCCC2.[Ti](Cl)Cl
SPLASH splash10-014i-0009100000-2183d7953d1de7e822c5
Source of Spectrum QE-24-SM11-rac-13 (DOI: 10.1002/chem.201804497)
Thin-Layer Chromatography 0.4 (standard silica gel, n-pentane/CH2Cl2, 1:1)
Wiley ID 1901801