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Benzenebutanoic acid, .alpha.-[1-[(1,1-dimethylethyl)amino]ethyliden e]-.beta.-oxo-.gamma.-phenyl-, ethyl ester
SpectraBase Compound ID NsdCa4s4iK
InChI InChI=1S/C24H29NO3/c1-6-28-23(27)20(17(2)25-24(3,4)5)22(26)21(18-13-9-7-10-14-18)19-15-11-8-12-16-19/h7-16,21,25H,6H2,1-5H3/b20-17+
InChIKey OGHSZAVJGRPFKZ-LVZFUZTISA-N
Mol Weight 379.5 g/mol
Molecular Formula C24H29NO3
Exact Mass 379.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8oqoJWrl3Q8
Name Benzenebutanoic acid, .alpha.-[1-[(1,1-dimethylethyl)amino]ethyliden e]-.beta.-oxo-.gamma.-phenyl-, ethyl ester
Alternate Name(s) 3-(tert-butylamino)-2-benzylcarbonyl-2-butenoic acid ethyl ester Ethyl (2E)-3-(tert-butylamino)-2-(diphenylacetyl)-2-butenoate
CAS Registry Number 129000-00-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H29NO3
InChI InChI=1S/C24H29NO3/c1-6-28-23(27)20(17(2)25-24(3,4)5)22(26)21(18-13-9-7-10-14-18)19-15-11-8-12-16-19/h7-16,21,25H,6H2,1-5H3/b20-17+
InChIKey OGHSZAVJGRPFKZ-LVZFUZTISA-N
Molecular Weight 379.500 g/mol
SMILES N(\C(=C/(C(C(c1ccccc1)c1ccccc1)=O)C(=O)OCC)C)C(C)(C)C
SPLASH splash10-0bt9-1940000000-863d3629dc62971458d0
Source of Spectrum J-55-5154-5
Wiley ID 1359388