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Benzenepropanoic acid, 4-(cyclopentyloxy)-.beta.-[[4-(1,1-dimethylethyl)benzoyl]amino]-
SpectraBase Compound ID EjERUyRTDmB
InChI InChI=1S/C25H31NO4/c1-25(2,3)19-12-8-18(9-13-19)24(29)26-22(16-23(27)28)17-10-14-21(15-11-17)30-20-6-4-5-7-20/h8-15,20,22H,4-7,16H2,1-3H3,(H,26,29)(H,27,28)
InChIKey UHYFGUJAWZKFQQ-UHFFFAOYSA-N
Mol Weight 409.53 g/mol
Molecular Formula C25H31NO4
Exact Mass 409.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTQx5I9uynH
Name Benzenepropanoic acid, 4-(cyclopentyloxy)-.beta.-[[4-(1,1-dimethylethyl)benzoyl]amino]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31NO4
InChI InChI=1S/C25H31NO4/c1-25(2,3)19-12-8-18(9-13-19)24(29)26-22(16-23(27)28)17-10-14-21(15-11-17)30-20-6-4-5-7-20/h8-15,20,22H,4-7,16H2,1-3H3,(H,26,29)(H,27,28)
InChIKey UHYFGUJAWZKFQQ-UHFFFAOYSA-N
Molecular Weight 409.526 g/mol
SMILES OC(CC(c1ccc(cc1)OC1CCCC1)NC(=O)c1ccc(cc1)C(C)(C)C)=O
SPLASH splash10-01qc-5900000000-48ad560acbb593f77d6f
Source of Spectrum IY-1-4659-2
Synonyms 3-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-(4-cyclopentyloxyphenyl)propanoic acid 3-[(4-tert-butylbenzoyl)amino]-3-(4-cyclopentyloxyphenyl)propanoic acid 3-[(4-tert-butylbenzoyl)amino]-3-[4-(cyclopentoxy)phenyl]propanoic acid 3-[(4-tert-butylphenyl)carbonylamino]-3-(4-cyclopentyloxyphenyl)propanoic acid
Wiley ID 1654575