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2-(N-Fluoren-9-ylmethoxycarbonylamino)-3-(tert-butyloxycarbonylamino)-3-(tolylthiocarbonyl)-1-phenylpropane
SpectraBase Compound ID GnrTV4dAluT
InChI InChI=1S/C37H38N2O5S/c1-24-18-20-26(21-19-24)45-34(40)33(39-36(42)44-37(2,3)4)32(22-25-12-6-5-7-13-25)38-35(41)43-23-31-29-16-10-8-14-27(29)28-15-9-11-17-30(28)31/h5-21,31-33H,22-23H2,1-4H3,(H,38,41)(H,39,42)/t32-,33-/m0/s1
InChIKey NKHZWKGXVVWPEL-LQJZCPKCSA-N
Mol Weight 622.8 g/mol
Molecular Formula C37H38N2O5S
Exact Mass 622.250144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2shp2AV5px
Name 2-(N-Fluoren-9-ylmethoxycarbonylamino)-3-(tert-butyloxycarbonylamino)-3-(tolylthiocarbonyl)-1-phenylpropane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H38N2O5S
InChI InChI=1S/C37H38N2O5S/c1-24-18-20-26(21-19-24)45-34(40)33(39-36(42)44-37(2,3)4)32(22-25-12-6-5-7-13-25)38-35(41)43-23-31-29-16-10-8-14-27(29)28-15-9-11-17-30(28)31/h5-21,31-33H,22-23H2,1-4H3,(H,38,41)(H,39,42)/t32-,33-/m0/s1
InChIKey NKHZWKGXVVWPEL-LQJZCPKCSA-N
Molecular Weight 622.780 g/mol
SMILES N(C(OCC1c2c(cccc2)-c2c1cccc2)=O)[C@]([C@@](C(Sc1ccc(cc1)C)=O)(NC(OC(C)(C)C)=O)[H])(Cc1ccccc1)[H]
SPLASH splash10-004i-0901000000-9b8114306c6f78e0be84
Source of Spectrum CV-2002-2307-32
Synonyms (2S,3S)-2-tert-Butoxycarbonylamino-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenyl-thiobutyric acid S-p-tolyl ester 2-Benzyl-1-(N-tert-butoxycarbonyl)amino-1-(tolylthiocarbonyl)-2-(N-fluoren-9-ylmethoxycarbonyl)ethane
Wiley ID 1610349