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5-[[methyl(prop-2-ynyl)amino]methyl]-1,3-benzodioxole-4-carboxylic acid ethyl ester
SpectraBase Compound ID FxO1aIvnrUO
InChI InChI=1S/C15H17NO4/c1-4-8-16(3)9-11-6-7-12-14(20-10-19-12)13(11)15(17)18-5-2/h1,6-7H,5,8-10H2,2-3H3
InChIKey ZMDLYMQKZICDCM-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFISULyqDia
Name 5-[[methyl(prop-2-ynyl)amino]methyl]-1,3-benzodioxole-4-carboxylic acid ethyl ester
Alternate Name(s) 5-[[methyl(propargyl)amino]methyl]-1,3-benzodioxole-4-carboxylic acid ethyl ester Ethyl 5-[[methyl(prop-2-ynyl)amino]methyl]-1,3-benzodioxole-4-carboxylate
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Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-4-8-16(3)9-11-6-7-12-14(20-10-19-12)13(11)15(17)18-5-2/h1,6-7H,5,8-10H2,2-3H3
InChIKey ZMDLYMQKZICDCM-UHFFFAOYSA-N
Molecular Weight 275.304 g/mol
SMILES c1(c(CN(CC#C)C)ccc2c1OCO2)C(=O)OCC
SPLASH splash10-004r-0190000000-c33e2eac4b229bfdac6a
Source of Spectrum F-54-10124-1
Wiley ID 808335