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3-Ethyl-4-(3-isopropyl-1H-indazol-1-yl)-1-phenyl-1H-pyrrole-2,5-dione
SpectraBase Compound ID 2Lg5yNw70xM
InChI InChI=1S/C22H21N3O2/c1-4-16-20(22(27)24(21(16)26)15-10-6-5-7-11-15)25-18-13-9-8-12-17(18)19(23-25)14(2)3/h5-14H,4H2,1-3H3
InChIKey DDKRWHIFIBBYAJ-UHFFFAOYSA-N
Mol Weight 359.43 g/mol
Molecular Formula C22H21N3O2
Exact Mass 359.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUbpw62HuSZ
Name 3-Ethyl-4-(3-isopropyl-1H-indazol-1-yl)-1-phenyl-1H-pyrrole-2,5-dione
Appearance Yellow oil
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Exact Mass 359.163376926 u
Formula C22H21N3O2
InChI InChI=1S/C22H21N3O2/c1-4-16-20(22(27)24(21(16)26)15-10-6-5-7-11-15)25-18-13-9-8-12-17(18)19(23-25)14(2)3/h5-14H,4H2,1-3H3
InChIKey DDKRWHIFIBBYAJ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo302463q
Molecular Weight 359.429 g/mol
Reported Formula C22H21N3O2
SMILES C12=CC=CC=C2N(N=C1C(C)C)C=1C(N(C(C1CC)=O)C1=CC=CC=C1)=O
SPLASH splash10-000g-0149000000-98933e77a481454c26f9
Source of Spectrum JOC-78-635-18h (DOI: 10.1021/jo302463q)
Wiley ID 1911721