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Oxodopine
SpectraBase Compound ID L0xZOL52SKA
InChI InChI=1S/C19H21NO6/c1-10-12(6-7-16(21)22)18(14(8-17(23)24)11(2)20-10)13-4-3-5-15-19(13)26-9-25-15/h3-5,18,20H,6-9H2,1-2H3,(H,21,22)(H,23,24)
InChIKey RCQUKHBBNNMUKJ-UHFFFAOYSA-N
Mol Weight 359.38 g/mol
Molecular Formula C19H21NO6
Exact Mass 359.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiOkEFmWJY2
Name Oxodopine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO6
InChI InChI=1S/C19H21NO6/c1-10-12(6-7-16(21)22)18(14(8-17(23)24)11(2)20-10)13-4-3-5-15-19(13)26-9-25-15/h3-5,18,20H,6-9H2,1-2H3,(H,21,22)(H,23,24)
InChIKey RCQUKHBBNNMUKJ-UHFFFAOYSA-N
Molecular Weight 359.378 g/mol
SMILES OC(CCC=1C(C(CC(=O)O)=C(NC1C)C)c1c2OCOc2ccc1)=O
SPLASH splash10-000i-0493000000-0a957449649dbba2a8a7
Source of Spectrum JC-562-43-3
Synonyms 3-Methoxycarbonyl-4-(1',3'-dioxabicyclo[4.3.0]nona-5',7',9'(4')-trien-5'-yl)-5-ethoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine 3-[4-(1,3-benzodioxol-4-yl)-5-(carboxymethyl)-2,6-dimethyl-1,4-dihydro-3-pyridinyl]propanoic acid
Wiley ID 1347745