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Ethyl 2-[(S)-2-(1-benzyloxycarbonylpyrrolidin-2-yl)carbonyl]amio-2-(diethoxyphosphoryl)acetate
SpectraBase Compound ID KwHV6gdtLbK
InChI InChI=1S/C21H31N2O8P/c1-4-28-20(25)19(32(27,30-5-2)31-6-3)22-18(24)17-13-10-14-23(17)21(26)29-15-16-11-8-7-9-12-16/h7-9,11-12,17,19H,4-6,10,13-15H2,1-3H3,(H,22,24)/t17-,19?/m0/s1
InChIKey WQBKFYKTUTVSBS-KKFHFHRHSA-N
Mol Weight 470.46 g/mol
Molecular Formula C21H31N2O8P
Exact Mass 470.181803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FY3JpqQyO0R
Name Ethyl 2-[(S)-2-(1-benzyloxycarbonylpyrrolidin-2-yl)carbonyl]amio-2-(diethoxyphosphoryl)acetate
Alternate Name(s) (S)-2-{[(Diethoxy-phosphoryl)-ethoxycarbonyl-methyl]-carbamoyl}-pyrrolidine-1-carboxylic acid benzyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31N2O8P
InChI InChI=1S/C21H31N2O8P/c1-4-28-20(25)19(32(27,30-5-2)31-6-3)22-18(24)17-13-10-14-23(17)21(26)29-15-16-11-8-7-9-12-16/h7-9,11-12,17,19H,4-6,10,13-15H2,1-3H3,(H,22,24)/t17-,19?/m0/s1
InChIKey WQBKFYKTUTVSBS-KKFHFHRHSA-N
Molecular Weight 470.459 g/mol
SMILES N(C(P(=O)(OCC)OCC)C(=O)OCC)C([C@]1(N(C(OCc2ccccc2)=O)CCC1)[H])=O
SPLASH splash10-0006-9210000000-6bec7f058abdb4e2dbf9
Source of Spectrum QE-6-2164-9
Wiley ID 844725