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N-(Benzo[d][1,3]dioxol-4-yl)-N-methyl-3-oxobutanamide
SpectraBase Compound ID LYwWFSuQBWy
InChI InChI=1S/C12H13NO4/c1-8(14)6-11(15)13(2)9-4-3-5-10-12(9)17-7-16-10/h3-5H,6-7H2,1-2H3
InChIKey WOTCNSPIYGMSPG-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LwIPzc67ylS
Name N-(Benzo[d][1,3]dioxol-4-yl)-N-methyl-3-oxobutanamide
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-8(14)6-11(15)13(2)9-4-3-5-10-12(9)17-7-16-10/h3-5H,6-7H2,1-2H3
InChIKey WOTCNSPIYGMSPG-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jm801335z
Molecular Weight 235.239 g/mol
Reported Formula C12H13NO4
SMILES c1ccc(c2OCOc12)N(C(CC(C)=O)=O)C
SPLASH splash10-0udi-2920000000-f59acd034da8bf34baae
Source of Spectrum AF-52-1882-10b
Wiley ID 1873778