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(S)-1,1-Dimethylethyl 2-[(4-(Benzoylamino)-1,2-dihydro-2-oxo-1-pyrimidinyl)methyl]-6-oxo-1-piperidinecarboxylate
SpectraBase Compound ID 4q9YDf0gASm
InChI InChI=1S/C22H26N4O5/c1-22(2,3)31-21(30)26-16(10-7-11-18(26)27)14-25-13-12-17(24-20(25)29)23-19(28)15-8-5-4-6-9-15/h4-6,8-9,12-13,16H,7,10-11,14H2,1-3H3,(H,23,24,28,29)/t16-/m0/s1
InChIKey OFGAFLOMTNVPTE-INIZCTEOSA-N
Mol Weight 426.47 g/mol
Molecular Formula C22H26N4O5
Exact Mass 426.19032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fs8B4ZZmmR0
Name (S)-1,1-Dimethylethyl 2-[(4-(Benzoylamino)-1,2-dihydro-2-oxo-1-pyrimidinyl)methyl]-6-oxo-1-piperidinecarboxylate
Alternate Name(s) tert-Butyl (2S)-2-[(4-(benzoylamino)-2-oxo-1(2H)-pyrimidinyl)methyl]-6-oxo-1-piperidinecarboxylate
CAS Registry Number 135697-17-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N4O5
InChI InChI=1S/C22H26N4O5/c1-22(2,3)31-21(30)26-16(10-7-11-18(26)27)14-25-13-12-17(24-20(25)29)23-19(28)15-8-5-4-6-9-15/h4-6,8-9,12-13,16H,7,10-11,14H2,1-3H3,(H,23,24,28,29)/t16-/m0/s1
InChIKey OFGAFLOMTNVPTE-INIZCTEOSA-N
Molecular Weight 426.473 g/mol
SMILES N(C=1C=CN(C(N1)=O)C[C@]1(N(C(OC(C)(C)C)=O)C(=O)CCC1)[H])C(=O)c1ccccc1
SPLASH splash10-0a6r-9550000000-59b53c2003978d73d896
Source of Spectrum J-56-6013-12
Wiley ID 1379872