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3-(tert-Butyldimethylsilyl)-2-isobutyl-1-tosyl-1H-pyrrole
SpectraBase Compound ID 4uEIxCrVm8D
InChI InChI=1S/C21H33NO2SSi/c1-16(2)15-19-20(26(7,8)21(4,5)6)13-14-22(19)25(23,24)18-11-9-17(3)10-12-18/h9-14,16H,15H2,1-8H3
InChIKey HQYWVCBBDGQJKA-UHFFFAOYSA-N
Mol Weight 391.6 g/mol
Molecular Formula C21H33NO2SSi
Exact Mass 391.200127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EC8eO7KJE5v
Name 3-(tert-Butyldimethylsilyl)-2-isobutyl-1-tosyl-1H-pyrrole
Appearance Pale yellow oil
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Exact Mass 391.200127014 u
Formula C21H33NO2SSi
InChI InChI=1S/C21H33NO2SSi/c1-16(2)15-19-20(26(7,8)21(4,5)6)13-14-22(19)25(23,24)18-11-9-17(3)10-12-18/h9-14,16H,15H2,1-8H3
InChIKey HQYWVCBBDGQJKA-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201600961
Molecular Weight 391.645 g/mol
Quality 167
Reported Formula C21H33NO2SSi
SMILES C=1(N(C=CC1[Si](C(C)(C)C)(C)C)S(C=1C=CC(C)=CC1)(=O)=O)CC(C)C
SPLASH splash10-001i-1409000000-77f1114404e14c899cd5
Source of Spectrum ACI-55-SM15-12e (DOI: 10.1002/anie.201600961)
Wiley ID 1897355