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(S)-Dibenzyl cyano(4-methylphenylsulfonamido)(phenyl)methylphosphonate
SpectraBase Compound ID HBh3W2p8Wn3
InChI InChI=1S/C29H27N2O5PS/c1-24-17-19-28(20-18-24)38(33,34)31-29(23-30,27-15-9-4-10-16-27)37(32,35-21-25-11-5-2-6-12-25)36-22-26-13-7-3-8-14-26/h2-20,31H,21-22H2,1H3/t29-/m1/s1
InChIKey GGWGQJMPZQLXNV-GDLZYMKVSA-N
Mol Weight 546.58 g/mol
Molecular Formula C29H27N2O5PS
Exact Mass 546.13783 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82xOwXZPrGz
Name (S)-Dibenzyl cyano(4-methylphenylsulfonamido)(phenyl)methylphosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H27N2O5PS
InChI InChI=1S/C29H27N2O5PS/c1-24-17-19-28(20-18-24)38(33,34)31-29(23-30,27-15-9-4-10-16-27)37(32,35-21-25-11-5-2-6-12-25)36-22-26-13-7-3-8-14-26/h2-20,31H,21-22H2,1H3/t29-/m1/s1
InChIKey GGWGQJMPZQLXNV-GDLZYMKVSA-N
Literature Reference DOI 10.1002/adsc.201200516
Molecular Weight 546.578 g/mol
SMILES N(S(=O)(c1ccc(cc1)C)=O)[C@@](c1ccccc1)(P(=O)(OCc1ccccc1)OCc1ccccc1)C#N
SPLASH splash10-052f-9800000000-9d1c6b1f0410037cb364
Source of Spectrum ASC-354-2641/SM11-11a
Synonyms Dibenzyl (cyano(4-methylphenylsulfonamido)(phenyl)methyl)phosphonate
Wiley ID 1762747