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2-[2'-(2",2"-Dimethyl-4",6"-dioxo-(1,3)-dioxan-5"-yl)-2'-(1H-indol-3"'-yl)ethyl]-isoindole-1,3-dione - Butylammonium Salt

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2-[2'-(2",2"-Dimethyl-4",6"-dioxo-(1,3)-dioxan-5"-yl)-2'-(1H-indol-3"'-yl)ethyl]-isoindole-1,3-dione - Butylammonium Salt
SpectraBase Compound ID F8Yy7usSPVF
InChI InChI=1S/C24H19N2O6.C4H11N/c1-24(2)31-22(29)19(23(30)32-24)17(16-11-25-18-10-6-5-7-13(16)18)12-26-20(27)14-8-3-4-9-15(14)21(26)28;1-2-3-4-5/h3-11,17,25H,12H2,1-2H3;2-5H2,1H3/q-1;/p+1
InChIKey IPRAKIFHRNCWKB-UHFFFAOYSA-O
Mol Weight 505.57 g/mol
Molecular Formula C28H31N3O6
Exact Mass 505.221286 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oImER8JFWg
Name 2-[2'-(2",2"-Dimethyl-4",6"-dioxo-(1,3)-dioxan-5"-yl)-2'-(1H-indol-3"'-yl)ethyl]-isoindole-1,3-dione - Butylammonium Salt
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Formula C28H31N3O6
InChI InChI=1S/C24H19N2O6.C4H11N/c1-24(2)31-22(29)19(23(30)32-24)17(16-11-25-18-10-6-5-7-13(16)18)12-26-20(27)14-8-3-4-9-15(14)21(26)28;1-2-3-4-5/h3-11,17,25H,12H2,1-2H3;2-5H2,1H3/q-1;/p+1
InChIKey IPRAKIFHRNCWKB-UHFFFAOYSA-O
Molecular Weight 505.571 g/mol
SMILES C([NH3+])CCC.[nH]1c2c(c(c1)C([C-]1C(OC(OC1=O)(C)C)=O)CN1C(c3ccccc3C1=O)=O)cccc2
SPLASH splash10-01ox-0910000000-bc0341ec5fb08fadca00
Source of Spectrum AH-134-1645-4
Wiley ID 1547061