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Benzenepropanoic acid, .beta.-[([1,1'-biphenyl]-4-ylcarbonyl)amino]-4-(1,1-dimethylethyl)-
SpectraBase Compound ID 1kZbSR4uQMe
InChI InChI=1S/C26H27NO3/c1-26(2,3)22-15-13-20(14-16-22)23(17-24(28)29)27-25(30)21-11-9-19(10-12-21)18-7-5-4-6-8-18/h4-16,23H,17H2,1-3H3,(H,27,30)(H,28,29)
InChIKey HKHUCUIQFSXRHZ-UHFFFAOYSA-N
Mol Weight 401.51 g/mol
Molecular Formula C26H27NO3
Exact Mass 401.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ci6XjTXYVIB
Name Benzenepropanoic acid, .beta.-[([1,1'-biphenyl]-4-ylcarbonyl)amino]-4-(1,1-dimethylethyl)-
Alternate Name(s) 3-(4-tert-butylphenyl)-3-[[oxo-(4-phenylphenyl)methyl]amino]propanoic acid 3-(4-tert-butylphenyl)-3-[(4-phenylbenzoyl)amino]propanoic acid 3-(4-tert-butylphenyl)-3-[(4-phenylphenyl)carbonylamino]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H27NO3
InChI InChI=1S/C26H27NO3/c1-26(2,3)22-15-13-20(14-16-22)23(17-24(28)29)27-25(30)21-11-9-19(10-12-21)18-7-5-4-6-8-18/h4-16,23H,17H2,1-3H3,(H,27,30)(H,28,29)
InChIKey HKHUCUIQFSXRHZ-UHFFFAOYSA-N
Molecular Weight 401.506 g/mol
SMILES OC(CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1ccc(cc1)-c1ccccc1)=O
SPLASH splash10-0f89-1910000000-80c2d3bc7c86a076545b
Source of Spectrum IY-1-4663-6
Wiley ID 1654619