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4-(3-(tert-Butyldimethylsilyl)-1-tosyl-1H-pyrrol-2-yl)benzonitrile
SpectraBase Compound ID 34CO6R9JMPX
InChI InChI=1S/C24H28N2O2SSi/c1-18-7-13-21(14-8-18)29(27,28)26-16-15-22(30(5,6)24(2,3)4)23(26)20-11-9-19(17-25)10-12-20/h7-16H,1-6H3
InChIKey RFPYPNVTDNDVSZ-UHFFFAOYSA-N
Mol Weight 436.65 g/mol
Molecular Formula C24H28N2O2SSi
Exact Mass 436.164076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvNFUX9dQKs
Name 4-(3-(tert-Butyldimethylsilyl)-1-tosyl-1H-pyrrol-2-yl)benzonitrile
Appearance White solid
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Exact Mass 436.164075857 u
Formula C24H28N2O2SSi
InChI InChI=1S/C24H28N2O2SSi/c1-18-7-13-21(14-8-18)29(27,28)26-16-15-22(30(5,6)24(2,3)4)23(26)20-11-9-19(17-25)10-12-20/h7-16H,1-6H3
InChIKey RFPYPNVTDNDVSZ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201600961
Molecular Weight 436.645 g/mol
Quality 112
Reported Formula C24H28N2O2SSi
SMILES C=1(N(C=CC1[Si](C(C)(C)C)(C)C)S(C1=CC=C(C=C1)C)(=O)=O)C1=CC=C(C=C1)C#N
SPLASH splash10-00b9-0069000000-d882afa1253ddcb7498b
Source of Spectrum ACI-55-SM12-12a (DOI: 10.1002/anie.201600961)
Wiley ID 1897351