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SpectraBase Compound ID | E67pRR7Qevq |
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InChI | InChI=1S/C13H15NO4/c1-9(15)10-3-5-11(6-4-10)14-12(16)7-8-13(17)18-2/h3-6H,7-8H2,1-2H3,(H,14,16) |
InChIKey | FSGPLFFTRCTCFQ-UHFFFAOYSA-N |
Mol Weight | 249.27 g/mol |
Molecular Formula | C13H15NO4 |
Exact Mass | 249.100108 g/mol |
SpectraBase Spectrum ID | HPJUoTB2twa |
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Name | Butanoic acid, 4-[(4-acetylphenyl)amino]-4-oxo-, methyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 249.100107963 u |
Formula | C13H15NO4 |
InChI | InChI=1S/C13H15NO4/c1-9(15)10-3-5-11(6-4-10)14-12(16)7-8-13(17)18-2/h3-6H,7-8H2,1-2H3,(H,14,16) |
InChIKey | FSGPLFFTRCTCFQ-UHFFFAOYSA-N |
Molecular Weight | 249.266 g/mol |
SMILES | N(C(=O)CCC(=O)OC)C=1C=CC(C(=O)C)=CC1 |