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4-Imidazolidinepropanoic acid, 3-benzoyl-2-(1,1-dimethylethyl)-1-methyl-5-oxo-, (2S-trans)-
SpectraBase Compound ID IcwZ1RkzjzY
InChI InChI=1S/C18H24N2O4/c1-18(2,3)17-19(4)16(24)13(10-11-14(21)22)20(17)15(23)12-8-6-5-7-9-12/h5-9,13,17H,10-11H2,1-4H3,(H,21,22)/t13-,17-/m0/s1
InChIKey ZHPBUZCUPRVIQY-GUYCJALGSA-N
Mol Weight 332.4 g/mol
Molecular Formula C18H24N2O4
Exact Mass 332.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4P2NPHFWeNu
Name 4-Imidazolidinepropanoic acid, 3-benzoyl-2-(1,1-dimethylethyl)-1-methyl-5-oxo-, (2S-trans)-
CAS Registry Number 103825-47-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N2O4
InChI InChI=1S/C18H24N2O4/c1-18(2,3)17-19(4)16(24)13(10-11-14(21)22)20(17)15(23)12-8-6-5-7-9-12/h5-9,13,17H,10-11H2,1-4H3,(H,21,22)/t13-,17-/m0/s1
InChIKey ZHPBUZCUPRVIQY-GUYCJALGSA-N
Molecular Weight 332.400 g/mol
SMILES OC(CC[C@]1(C(=O)N([C@@](N1C(=O)c1ccccc1)(C(C)(C)C)[H])C)[H])=O
SPLASH splash10-0a4i-1910000000-0191cac7eae19eca20d3
Source of Spectrum H-68-1514-11
Synonyms 3-[(2S,4S)-3-benzoyl-2-(tert-butyl)-1-methyl-5-oxoimidazolidin-4-yl]propionic acid 3-[(2S,4S)-3-benzoyl-2-tert-butyl-1-methyl-5-oxoimidazolidinyl]propanoic acid
Wiley ID 1329391