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Methyl 2-hydroxy-4-oxo-4-(4-hexylamino-6-methyl-2-pyrone-3-yl)-2-butenoate
SpectraBase Compound ID IdIr10K2EY3
InChI InChI=1S/C17H23NO6/c1-4-5-6-7-8-18-12-9-11(2)24-17(22)15(12)13(19)10-14(20)16(21)23-3/h9,15H,4-8,10H2,1-3H3/b18-12+
InChIKey GJWGMUHSKOHJCZ-LDADJPATSA-N
Mol Weight 337.37 g/mol
Molecular Formula C17H23NO6
Exact Mass 337.152537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ZdqLf9hltJ
Name Methyl 2-hydroxy-4-oxo-4-(4-hexylamino-6-methyl-2-pyrone-3-yl)-2-butenoate
CAS Registry Number 86488-08-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO6
InChI InChI=1S/C17H23NO6/c1-4-5-6-7-8-18-12-9-11(2)24-17(22)15(12)13(19)10-14(20)16(21)23-3/h9,15H,4-8,10H2,1-3H3/b18-12+
InChIKey GJWGMUHSKOHJCZ-LDADJPATSA-N
Molecular Weight 337.372 g/mol
SMILES CC=1OC(C(C(=O)CC(C(=O)OC)=O)\C(C1)=N\CCCCCC)=O
SPLASH splash10-00ko-4922000000-6e0a9c8d9de8bd892c94
Source of Spectrum W5-1989-35366-30170
Synonyms 4-(4-Hexylamino-6-methyl-2-oxo-2H-pyran-3-yl)-2-hydroxy-4-oxo-but-2-enoic acid M 4-(4-Hexylamino-6-methyl-2-oxo-2H-pyran-3-yl)-2-hydroxy-4-oxo-but-2-enoic acid methyl ester Methyl 4-{(4E)-4-[(E)-hexylimino]-6-methyl-2-oxo-3,4-dihydro-2H-pyran-3-yl}-2,4-dioxobutanoate Methyl 4-{4-[hexylimino]-6-methyl-2-oxo-3,4-dihydro-2H-pyran-3-yl}-2,4-dioxobutanoate
Wiley ID 1333025