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4-Imidazolidineacetic acid, 3-benzoyl-2-(1,1-dimethylethyl)-1-methyl-5-oxo-, methyl ester, (2S-trans)-
SpectraBase Compound ID L6asFiznOqp
InChI InChI=1S/C18H24N2O4/c1-18(2,3)17-19(4)16(23)13(11-14(21)24-5)20(17)15(22)12-9-7-6-8-10-12/h6-10,13,17H,11H2,1-5H3/t13-,17-/m0/s1
InChIKey OBPFGQLNAYVLGR-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 8MjjrMGprXE
Name 4-Imidazolidineacetic acid, 3-benzoyl-2-(1,1-dimethylethyl)-1-methyl-5-oxo-, methyl ester, (2S-trans)-
CAS Registry Number 103825-42-9
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(23)13(11-14(21)24-5)20(17)15(22)12-9-7-6-8-10-12/h6-10,13,17H,11H2,1-5H3/t13-,17-/m0/s1
InChIKey OBPFGQLNAYVLGR-GUYCJALGSA-N
Molecular Weight 332.400 g/mol
SMILES [C@@]1(N([C@](C(N1C)=O)(CC(=O)OC)[H])C(=O)c1ccccc1)(C(C)(C)C)[H]
SPLASH splash10-0a6r-2920000000-c914beb47eb80991e8fd
Source of Spectrum H-68-1512-10
Synonyms 2-[(2S,4S)-3-benzoyl-2-(tert-butyl)-1-methyl-5-oxoimidazolidin-4-yl]acetic acid-methylester Methyl[(2S,4S)-3-benzoyl-2-tert-butyl-1-methyl-5-oxoimidazolidinyl]acetate
Wiley ID 1329389