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N-(Benzo[d][1,3]dioxol-4-yl)-3-oxobutanamide
SpectraBase Compound ID Anu1dlpLAgg
InChI InChI=1S/C11H11NO4/c1-7(13)5-10(14)12-8-3-2-4-9-11(8)16-6-15-9/h2-4H,5-6H2,1H3,(H,12,14)
InChIKey QLBUXBNJVXMISM-UHFFFAOYSA-N
Mol Weight 221.21 g/mol
Molecular Formula C11H11NO4
Exact Mass 221.068808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID elQyfLsZZj
Name N-(Benzo[d][1,3]dioxol-4-yl)-3-oxobutanamide
Appearance Colorless solid
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Formula C11H11NO4
InChI InChI=1S/C11H11NO4/c1-7(13)5-10(14)12-8-3-2-4-9-11(8)16-6-15-9/h2-4H,5-6H2,1H3,(H,12,14)
InChIKey QLBUXBNJVXMISM-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jm801335z
Molecular Weight 221.212 g/mol
Reported Formula C11H11NO4
SMILES N(c1cccc2c1OCO2)C(CC(C)=O)=O
SPLASH splash10-000i-1900000000-a9305fc26b6bb89e54ab
Source of Spectrum AF-52-1882-10a
Wiley ID 1873777