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Methyl 4-([5-oxo-5-(2-oxo-2-phenylethoxy)pentanoyl]amino)benzoate
SpectraBase Compound ID Ab4r7kW7MZq
InChI InChI=1S/C21H21NO6/c1-27-21(26)16-10-12-17(13-11-16)22-19(24)8-5-9-20(25)28-14-18(23)15-6-3-2-4-7-15/h2-4,6-7,10-13H,5,8-9,14H2,1H3,(H,22,24)
InChIKey SWHCFCRHANNQDR-UHFFFAOYSA-N
Mol Weight 383.4 g/mol
Molecular Formula C21H21NO6
Exact Mass 383.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWoHuFRosfz
Name Methyl 4-([5-oxo-5-(2-oxo-2-phenylethoxy)pentanoyl]amino)benzoate
CAS Registry Number 339246-79-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO6
InChI InChI=1S/C21H21NO6/c1-27-21(26)16-10-12-17(13-11-16)22-19(24)8-5-9-20(25)28-14-18(23)15-6-3-2-4-7-15/h2-4,6-7,10-13H,5,8-9,14H2,1H3,(H,22,24)
InChIKey SWHCFCRHANNQDR-UHFFFAOYSA-N
Molecular Weight 383.400 g/mol
SMILES N(C(=O)CCCC(OCC(=O)c1ccccc1)=O)c1ccc(C(=O)OC)cc1
SPLASH splash10-0a4l-9500000000-c5c514f3f2ab5a5309ed
Source of Spectrum AD-0-2532-0
Synonyms 4-[(1,5-dioxo-5-phenacyloxypentyl)amino]benzoic acid methyl ester 4-[(5-keto-5-phenacyloxy-pentanoyl)amino]benzoic acid methyl ester Glutaric acid monoamide, N-4-carbomethoxyphenyl-, benzoylmethyl ester Methyl 4-[(5-oxidanylidene-5-phenacyloxy-pentanoyl)amino]benzoate Methyl 4-[(5-oxo-5-phenacyloxy-pentanoyl)amino]benzoate
Wiley ID 1422424