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3,3-Dimethyl-1-(N-tert-butoxycarbonyl)amino-1-(tolylthiocarbonyl)-2-(N-fluoren-9-ylmethoxycarbonyl)butane
SpectraBase Compound ID 3GP5zScL7gn
InChI InChI=1S/C34H40N2O5S/c1-21-16-18-22(19-17-21)42-30(37)28(35-32(39)41-34(5,6)7)29(33(2,3)4)36-31(38)40-20-27-25-14-10-8-12-23(25)24-13-9-11-15-26(24)27/h8-19,27-29H,20H2,1-7H3,(H,35,39)(H,36,38)
InChIKey SKHRFDOVJFSRES-UHFFFAOYSA-N
Mol Weight 588.8 g/mol
Molecular Formula C34H40N2O5S
Exact Mass 588.265794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6mtnDurtpc
Name 3,3-Dimethyl-1-(N-tert-butoxycarbonyl)amino-1-(tolylthiocarbonyl)-2-(N-fluoren-9-ylmethoxycarbonyl)butane
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Formula C34H40N2O5S
InChI InChI=1S/C34H40N2O5S/c1-21-16-18-22(19-17-21)42-30(37)28(35-32(39)41-34(5,6)7)29(33(2,3)4)36-31(38)40-20-27-25-14-10-8-12-23(25)24-13-9-11-15-26(24)27/h8-19,27-29H,20H2,1-7H3,(H,35,39)(H,36,38)
InChIKey SKHRFDOVJFSRES-UHFFFAOYSA-N
Molecular Weight 588.763 g/mol
SMILES N(C(OCC1c2c(cccc2)-c2c1cccc2)=O)C(C(C(Sc1ccc(cc1)C)=O)NC(OC(C)(C)C)=O)C(C)(C)C
SPLASH splash10-004i-0911000000-3936e4f9988d8a1fdddb
Source of Spectrum CV-2002-2307-32
Wiley ID 1610348