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3-Methoxycarbonyl-4-(1',3'-dioxabicyclo[4.3.0]nona-5',7',9'(4')-trien-5'-yl)-5-hydroxycarbonyl-2,6-dimethylpyridine
SpectraBase Compound ID 5OsDO2izxew
InChI InChI=1S/C17H15NO6/c1-8-12(16(19)20)14(13(9(2)18-8)17(21)22-3)10-5-4-6-11-15(10)24-7-23-11/h4-6H,7H2,1-3H3,(H,19,20)
InChIKey VUSFTUDFEKSDAF-UHFFFAOYSA-N
Mol Weight 329.31 g/mol
Molecular Formula C17H15NO6
Exact Mass 329.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EiHXwJgqEbh
Name 3-Methoxycarbonyl-4-(1',3'-dioxabicyclo[4.3.0]nona-5',7',9'(4')-trien-5'-yl)-5-hydroxycarbonyl-2,6-dimethylpyridine
Alternate Name(s) 4-(1,3-benzodioxol-4-yl)-5-(methoxycarbonyl)-2,6-dimethylnicotinic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NO6
InChI InChI=1S/C17H15NO6/c1-8-12(16(19)20)14(13(9(2)18-8)17(21)22-3)10-5-4-6-11-15(10)24-7-23-11/h4-6H,7H2,1-3H3,(H,19,20)
InChIKey VUSFTUDFEKSDAF-UHFFFAOYSA-N
Molecular Weight 329.308 g/mol
SMILES OC(c1c(c(c(nc1C)C)C(=O)OC)-c1c2OCOc2ccc1)=O
SPLASH splash10-004i-0955000000-77bf867d05724d2855d1
Source of Spectrum JC-562-43-4
Wiley ID 1327042