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4-[3-[6-(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)-2-pyridinyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester
SpectraBase Compound ID Cb7N1StqdNx
InChI InChI=1S/C29H31N5O2/c1-3-36-29(35)19-15-17-20(18-16-19)34-26-14-7-5-10-22(26)28(32-34)24-12-8-11-23(30-24)27-21-9-4-6-13-25(21)33(2)31-27/h8,11-12,15-18H,3-7,9-10,13-14H2,1-2H3
InChIKey MQDGFXPOUHPFJS-UHFFFAOYSA-N
Mol Weight 481.6 g/mol
Molecular Formula C29H31N5O2
Exact Mass 481.247775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDO1WuRGoLl
Name 4-[3-[6-(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)-2-pyridinyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester
Alternate Name(s) 4-[3-[6-(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoic acid ethyl ester Ethyl 4-[3-[6-(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)-2-pyridyl]-4,5,6,7-tetrahydroindazol-1-yl]benzoate Ethyl 4-[3-[6-(1-methyl-4,5,6,7-tetrahydroindazol-3-yl)pyridin-2-yl]-4,5,6,7-tetrahydroindazol-1-yl]benzoate
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Formula C29H31N5O2
InChI InChI=1S/C29H31N5O2/c1-3-36-29(35)19-15-17-20(18-16-19)34-26-14-7-5-10-22(26)28(32-34)24-12-8-11-23(30-24)27-21-9-4-6-13-25(21)33(2)31-27/h8,11-12,15-18H,3-7,9-10,13-14H2,1-2H3
InChIKey MQDGFXPOUHPFJS-UHFFFAOYSA-N
Molecular Weight 481.600 g/mol
SMILES c12[n](nc(c1CCCC2)-c1nc(-c2n[n](C)c3c2CCCC3)ccc1)-c1ccc(C(=O)OCC)cc1
SPLASH splash10-001i-1620900000-556860e995049cda7db7
Source of Spectrum J-63-240-6
Wiley ID 1395434