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3-[(2,2-Dimethyl-4,6-dioxo-1,3-dioxolan-5-yl)methyl]-5-cyanoindole
SpectraBase Compound ID EyJnSQwvKxa
InChI InChI=1S/C16H14N2O4/c1-16(2)21-14(19)12(15(20)22-16)6-10-8-18-13-4-3-9(7-17)5-11(10)13/h3-5,8,12,18H,6H2,1-2H3
InChIKey XTBMPWVHSPNZQB-UHFFFAOYSA-N
Mol Weight 298.3 g/mol
Molecular Formula C16H14N2O4
Exact Mass 298.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qKhnypcZx9
Name 3-[(2,2-Dimethyl-4,6-dioxo-1,3-dioxolan-5-yl)methyl]-5-cyanoindole
Alternate Name(s) 3-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)methyl]-1H-indole-5-carbonitrile 3-[[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-yl]methyl]-1H-indole-5-carbonitrile
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Formula C16H14N2O4
InChI InChI=1S/C16H14N2O4/c1-16(2)21-14(19)12(15(20)22-16)6-10-8-18-13-4-3-9(7-17)5-11(10)13/h3-5,8,12,18H,6H2,1-2H3
InChIKey XTBMPWVHSPNZQB-UHFFFAOYSA-N
Molecular Weight 298.298 g/mol
SMILES [nH]1c2c(c(c1)CC1C(OC(OC1=O)(C)C)=O)cc(cc2)C#N
SPLASH splash10-0a4j-0930000000-f5ad1df2874b2e6871e6
Source of Spectrum SO-0-256-2
Wiley ID 876360