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3-Methyl-2-phthalimidobut-3-enoic acid
SpectraBase Compound ID H6LNyKWgISu
InChI InChI=1S/C13H11NO4/c1-7(2)10(13(17)18)14-11(15)8-5-3-4-6-9(8)12(14)16/h3-6,10H,1H2,2H3,(H,17,18)/t10-/m1/s1
InChIKey PGHJPLYKFXLXGW-SNVBAGLBSA-N
Mol Weight 245.23 g/mol
Molecular Formula C13H11NO4
Exact Mass 245.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JLZ9B5zgCbZ
Name 3-Methyl-2-phthalimidobut-3-enoic acid
Alternate Name(s) (R)-2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-methyl-but-3-enoic acid 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methyl-3-butenoic acid
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Formula C13H11NO4
InChI InChI=1S/C13H11NO4/c1-7(2)10(13(17)18)14-11(15)8-5-3-4-6-9(8)12(14)16/h3-6,10H,1H2,2H3,(H,17,18)/t10-/m1/s1
InChIKey PGHJPLYKFXLXGW-SNVBAGLBSA-N
Molecular Weight 245.234 g/mol
SMILES OC([C@](N1C(c2ccccc2C1=O)=O)(C(=C)C)[H])=O
SPLASH splash10-0udi-3970000000-3fe828f6e4a40e63668a
Source of Spectrum SO-0-110-39
Wiley ID 872830