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2-(1,3-dioxo-2-isoindolyl)-4-fluoro-5-hydroxy-4-(hydroxymethyl)pentanoic acid methyl ester
SpectraBase Compound ID LDNcEJx4aIC
InChI InChI=1S/C15H16FNO6/c1-23-14(22)11(6-15(16,7-18)8-19)17-12(20)9-4-2-3-5-10(9)13(17)21/h2-5,11,18-19H,6-8H2,1H3
InChIKey BDQAODUJEMTMJC-UHFFFAOYSA-N
Mol Weight 325.29 g/mol
Molecular Formula C15H16FNO6
Exact Mass 325.096165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mxz0q2O8sD
Name 2-(1,3-dioxo-2-isoindolyl)-4-fluoro-5-hydroxy-4-(hydroxymethyl)pentanoic acid methyl ester
Alternate Name(s) 4-Fluoro-5-hydroxy-4-methylol-2-phthalimido-valeric acid methyl ester Methyl 2-(1,3-dioxoisoindol-2-yl)-4-fluoro-5-hydroxy-4-(hydroxymethyl)pentanoate Methyl 2-(1,3-dioxoisoindolin-2-yl)-4-fluoro-5-hydroxy-4-(hydroxymethyl)pentanoate Methyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-fluoranyl-4-(hydroxymethyl)-5-oxidanyl-pentanoate
CAS Registry Number 133384-84-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16FNO6
InChI InChI=1S/C15H16FNO6/c1-23-14(22)11(6-15(16,7-18)8-19)17-12(20)9-4-2-3-5-10(9)13(17)21/h2-5,11,18-19H,6-8H2,1H3
InChIKey BDQAODUJEMTMJC-UHFFFAOYSA-N
Molecular Weight 325.292 g/mol
SMILES OCC(CO)(CC(N1C(c2ccccc2C1=O)=O)C(=O)OC)F
SPLASH splash10-00l2-0910000000-add45f2839c1a11cd2d9
Source of Spectrum F-47-1011-37
Wiley ID 1323852