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2-(N-Fluoren-9-ylmethoxycarbonylamino)-3-(tert-butyloxycarbonylamino)-3-(tolylthiocarbonyl)propane
SpectraBase Compound ID BYGrBl7nK2Q
InChI InChI=1S/C31H34N2O5S/c1-19-14-16-21(17-15-19)39-28(34)27(33-30(36)38-31(3,4)5)20(2)32-29(35)37-18-26-24-12-8-6-10-22(24)23-11-7-9-13-25(23)26/h6-17,20,26-27H,18H2,1-5H3,(H,32,35)(H,33,36)/t20-,27-/m0/s1
InChIKey ILATZHSWDQXVJI-DCFHFQCYSA-N
Mol Weight 546.7 g/mol
Molecular Formula C31H34N2O5S
Exact Mass 546.218843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLOj0kQkVLg
Name 2-(N-Fluoren-9-ylmethoxycarbonylamino)-3-(tert-butyloxycarbonylamino)-3-(tolylthiocarbonyl)propane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34N2O5S
InChI InChI=1S/C31H34N2O5S/c1-19-14-16-21(17-15-19)39-28(34)27(33-30(36)38-31(3,4)5)20(2)32-29(35)37-18-26-24-12-8-6-10-22(24)23-11-7-9-13-25(23)26/h6-17,20,26-27H,18H2,1-5H3,(H,32,35)(H,33,36)/t20-,27-/m0/s1
InChIKey ILATZHSWDQXVJI-DCFHFQCYSA-N
Molecular Weight 546.682 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@]([C@@](NC(OCC1c2c(cccc2)-c2c1cccc2)=O)(C)[H])(C(Sc1ccc(cc1)C)=O)[H]
SPLASH splash10-004i-0910000000-abe5220d400126a742e7
Source of Spectrum CV-2002-2307-32
Synonyms (2S,3S)-2-tert-Butoxycarbonylamino-3-(9H-fluoren-9-ylmethoxycarbonylamino)-thiobutyric acid S-p-tolyl ester 1-(N-tert-Butoxycarbonyl)amino-1-(tolylthiocarbonyl)-2-(N-fluoren-9-ylmethoxycarbonyl)propane
Wiley ID 1610350