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Methyl 3-(2,2-dimethyl-1,3-benzodioxol-5-yl)-2-[(2,2,2-trifluoroacetyl)amino]propanoate
SpectraBase Compound ID Mt4J4ZC1pw
InChI InChI=1S/C15H16F3NO5/c1-14(2)23-10-5-4-8(7-11(10)24-14)6-9(12(20)22-3)19-13(21)15(16,17)18/h4-5,7,9H,6H2,1-3H3,(H,19,21)
InChIKey QVIURCMWOYDKPS-UHFFFAOYSA-N
Mol Weight 347.29 g/mol
Molecular Formula C15H16F3NO5
Exact Mass 347.098057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2CwwzTjZKJ4
Name Methyl 3-(2,2-dimethyl-1,3-benzodioxol-5-yl)-2-[(2,2,2-trifluoroacetyl)amino]propanoate
Appearance White crystals
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Formula C15H16F3NO5
InChI InChI=1S/C15H16F3NO5/c1-14(2)23-10-5-4-8(7-11(10)24-14)6-9(12(20)22-3)19-13(21)15(16,17)18/h4-5,7,9H,6H2,1-3H3,(H,19,21)
InChIKey QVIURCMWOYDKPS-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 347.290 g/mol
Reported Formula C15H16NO5F3
SMILES N(C(Cc1cc2OC(Oc2cc1)(C)C)C(=O)OC)C(C(F)(F)F)=O
SPLASH splash10-03di-0900000000-c66120b95498a43c7c53
Source of Spectrum US20100087622A1
Wiley ID 1842156