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Malonic acid, 2-formamido-2-[4-(4-hydroxy-3-methyl-2-butenyl)indol-3-yl]methyl-, dimethyl ester
SpectraBase Compound ID Dylql1x4s4o
InChI InChI=1S/C20H24N2O6/c1-13(11-23)7-8-14-5-4-6-16-17(14)15(10-21-16)9-20(22-12-24,18(25)27-2)19(26)28-3/h4-7,10,12,21,23H,8-9,11H2,1-3H3,(H,22,24)/b13-7+
InChIKey JNCGPCXUIMSJFA-NTUHNPAUSA-N
Mol Weight 388.42 g/mol
Molecular Formula C20H24N2O6
Exact Mass 388.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2q3doLaPJEt
Name Malonic acid, 2-formamido-2-[4-(4-hydroxy-3-methyl-2-butenyl)indol-3-yl]methyl-, dimethyl ester
Alternate Name(s) 2-formamido-2-[[4-[(E)-4-hydroxy-3-methyl-but-2-enyl]-1H-indol-3-yl]methyl]malonic acid dimethyl ester 2-formamido-2-[[4-[(E)-4-hydroxy-3-methylbut-2-enyl]-1H-indol-3-yl]methyl]propanedioic acid dimethyl ester Dimethyl 2-formamido-2-[[4-[(E)-3-methyl-4-oxidanyl-but-2-enyl]-1H-indol-3-yl]methyl]propanedioate Dimethyl 2-formamido-2-[[4-[(E)-4-hydroxy-3-methyl-but-2-enyl]-1H-indol-3-yl]methyl]propanedioate
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Formula C20H24N2O6
InChI InChI=1S/C20H24N2O6/c1-13(11-23)7-8-14-5-4-6-16-17(14)15(10-21-16)9-20(22-12-24,18(25)27-2)19(26)28-3/h4-7,10,12,21,23H,8-9,11H2,1-3H3,(H,22,24)/b13-7+
InChIKey JNCGPCXUIMSJFA-NTUHNPAUSA-N
Molecular Weight 388.420 g/mol
SMILES OC\C(=C\Cc1cccc2c1c(CC(C(=O)OC)(C(=O)OC)NC=O)c[nH]2)C
SPLASH splash10-052b-2910000000-21058863d1b2ebbb8edd
Wiley ID 1479372