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3-(4-tert-butylphenyl)-3-[(4-tert-butylphenyl)carbonylamino]propanoic acid
SpectraBase Compound ID LQofAc7Bxyt
InChI InChI=1S/C24H31NO3/c1-23(2,3)18-11-7-16(8-12-18)20(15-21(26)27)25-22(28)17-9-13-19(14-10-17)24(4,5)6/h7-14,20H,15H2,1-6H3,(H,25,28)(H,26,27)
InChIKey DJXVSMAWZRFGJL-UHFFFAOYSA-N
Mol Weight 381.52 g/mol
Molecular Formula C24H31NO3
Exact Mass 381.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNk8bD4XA
Name 3-(4-tert-butylphenyl)-3-[(4-tert-butylphenyl)carbonylamino]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO3
InChI InChI=1S/C24H31NO3/c1-23(2,3)18-11-7-16(8-12-18)20(15-21(26)27)25-22(28)17-9-13-19(14-10-17)24(4,5)6/h7-14,20H,15H2,1-6H3,(H,25,28)(H,26,27)
InChIKey DJXVSMAWZRFGJL-UHFFFAOYSA-N
Molecular Weight 381.516 g/mol
SMILES OC(CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1ccc(cc1)C(C)(C)C)=O
SPLASH splash10-03k9-5930000000-4a5a9c936fb966ce6fa0
Synonyms 3-(4-tert-butylphenyl)-3-[[(4-tert-butylphenyl)-oxomethyl]amino]propanoic acid 3-[(4-tert-butylbenzoyl)amino]-3-(4-tert-butylphenyl)propanoic acid
Wiley ID 1445781