For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-(4-Tert-butylphenyl)-3-[(4-nitrobenzoyl)amino]propanoic acid
SpectraBase Compound ID LiTDkHkWLYd
InChI InChI=1S/C20H22N2O5/c1-20(2,3)15-8-4-13(5-9-15)17(12-18(23)24)21-19(25)14-6-10-16(11-7-14)22(26)27/h4-11,17H,12H2,1-3H3,(H,21,25)(H,23,24)
InChIKey IBUOYHXPGONYFX-UHFFFAOYSA-N
Mol Weight 370.41 g/mol
Molecular Formula C20H22N2O5
Exact Mass 370.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7Rrim3iVf2R
Name 3-(4-tert-butylphenyl)-3-[(4-nitrobenzoyl)amino]propanoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O5
InChI InChI=1S/C20H22N2O5/c1-20(2,3)15-8-4-13(5-9-15)17(12-18(23)24)21-19(25)14-6-10-16(11-7-14)22(26)27/h4-11,17H,12H2,1-3H3,(H,21,25)(H,23,24)
InChIKey IBUOYHXPGONYFX-UHFFFAOYSA-N
Molecular Weight 370.405 g/mol
SMILES OC(CC(NC(c1ccc(N(=O)=O)cc1)=O)c1ccc(C(C)(C)C)cc1)=O
SPLASH splash10-0fk9-2961000000-3e8cfd2ce97b8d341af6
Synonyms 3-(4-tert-butylphenyl)-3-[(4-nitrophenyl)carbonylamino]propanoic acid 3-(4-tert-butylphenyl)-3-[[(4-nitrophenyl)-oxomethyl]amino]propanoic acid
Wiley ID 1510727