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(5S)-1-(2-diethoxyphosphoryl-1-oxoethyl)-5-[(triphenylmethyl)oxymethyl]-2-pyrrolidinone
SpectraBase Compound ID 2P224UrLx2A
InChI InChI=1S/C30H34NO6P/c1-3-36-38(34,37-4-2)23-29(33)31-27(20-21-28(31)32)22-35-30(24-14-8-5-9-15-24,25-16-10-6-11-17-25)26-18-12-7-13-19-26/h5-19,27H,3-4,20-23H2,1-2H3/t27-/m0/s1
InChIKey MQWLMQBHNJZEPP-MHZLTWQESA-N
Mol Weight 535.6 g/mol
Molecular Formula C30H34NO6P
Exact Mass 535.212375 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HgdWrKV5sHD
Name (5S)-1-(2-Diethoxyphosphoryl-1-oxoethyl)-5-[(triphenylmethyl)oxymethyl]-2-pyrrolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 535.212374811 u
Formula C30H34NO6P
InChI InChI=1S/C30H34NO6P/c1-3-36-38(34,37-4-2)23-29(33)31-27(20-21-28(31)32)22-35-30(24-14-8-5-9-15-24,25-16-10-6-11-17-25)26-18-12-7-13-19-26/h5-19,27H,3-4,20-23H2,1-2H3/t27-/m0/s1
InChIKey MQWLMQBHNJZEPP-MHZLTWQESA-N
Molecular Weight 535.577 g/mol
SMILES C1(N([C@@](CC1)(COC(C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1)[H])C(=O)CP(=O)(OCC)OCC)=O