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SPOROVEXIN-C
SpectraBase Compound ID KT7bCbglfnJ
InChI InChI=1S/C15H19NO6/c1-10(15(20)21)7-9-22-12-4-2-11(3-5-12)14(19)16-8-6-13(17)18/h2-5,10H,6-9H2,1H3,(H,16,19)(H,17,18)(H,20,21)
InChIKey AQYVBRADYQRCEE-UHFFFAOYSA-N
Mol Weight 309.32 g/mol
Molecular Formula C15H19NO6
Exact Mass 309.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBceWfgAqSc
Name 4-[4-(2-carboxyethylcarbamoyl)phenoxy]-2-methyl-butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO6
InChI InChI=1S/C15H19NO6/c1-10(15(20)21)7-9-22-12-4-2-11(3-5-12)14(19)16-8-6-13(17)18/h2-5,10H,6-9H2,1H3,(H,16,19)(H,17,18)(H,20,21)
InChIKey AQYVBRADYQRCEE-UHFFFAOYSA-N
Molecular Weight 309.318 g/mol
SMILES OC(C(CCOc1ccc(C(=O)NCCC(=O)O)cc1)C)=O
SPLASH splash10-00di-1910000000-ce277baf5a147aa205d8
Source of Spectrum G4-62-661-3
Synonyms 4-[4-(2-carboxyethylcarbamoyl)phenoxy]-2-methyl-butyric acid 4-[4-[(2-carboxyethylamino)-oxomethyl]phenoxy]-2-methylbutanoic acid Sporovexin C 4-[4-(2-carboxyethylcarbamoyl)phenoxy]-2-methylbutanoic acid
Wiley ID 1607859