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3-(2'-Nitroethyl)-4-[3'-(t-butyldimethylsilyloxy)-2'-(p-tolylthio)-1'-propen-1'-yl]-1-methylindole
SpectraBase Compound ID IDO33Eggbdl
InChI InChI=1S/C27H36N2O3SSi/c1-20-11-13-23(14-12-20)33-24(19-32-34(6,7)27(2,3)4)17-21-9-8-10-25-26(21)22(18-28(25)5)15-16-29(30)31/h8-14,17-18H,15-16,19H2,1-7H3/b24-17-
InChIKey IIHYBIZIHOENQV-ULJHMMPZSA-N
Mol Weight 496.7 g/mol
Molecular Formula C27H36N2O3SSi
Exact Mass 496.221591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqzqW7mVDKi
Name 3-(2'-Nitroethyl)-4-[3'-(t-butyldimethylsilyloxy)-2'-(p-tolylthio)-1'-propen-1'-yl]-1-methylindole
Comments Less than 3 mono-isotopic peaks
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Formula C27H36N2O3SSi
InChI InChI=1S/C27H36N2O3SSi/c1-20-11-13-23(14-12-20)33-24(19-32-34(6,7)27(2,3)4)17-21-9-8-10-25-26(21)22(18-28(25)5)15-16-29(30)31/h8-14,17-18H,15-16,19H2,1-7H3/b24-17-
InChIKey IIHYBIZIHOENQV-ULJHMMPZSA-N
Molecular Weight 496.741 g/mol
SMILES c1(c2c(cccc2\C=C\(Sc2ccc(cc2)C)CO[Si](C(C)(C)C)(C)C)[n](c1)C)CCN(=O)=O
SPLASH splash10-0f6t-0008900000-e42cec934c2a75a7c1be
Source of Spectrum U-1997-1976-45
Synonyms 4-{(1Z)-3-{[tert-butyl(dimethyl)silyl]oxy}-2-[(4-methylphenyl)sulfanyl]-1-propenyl}-1-methyl-3-(2-nitroethyl)-1H-indole tert-butyl(dimethyl)silyl (2Z)-3-[1-methyl-3-(2-nitroethyl)-1H-indol-4-yl]-2-[(4-methylphenyl)sulfanyl]-2-propenyl ether
Wiley ID 770153