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1,3-BIS-(1,2,3-1H-BENZOTRIAZOL-1-YL)-2-(PARA-METHOXYPHENYL)-ISOINDOLINE
SpectraBase Compound ID CIi0tdOjE0a
InChI InChI=1S/C27H21N7O/c1-35-19-16-14-18(15-17-19)32-26(33-24-12-6-4-10-22(24)28-30-33)20-8-2-3-9-21(20)27(32)34-25-13-7-5-11-23(25)29-31-34/h2-17,26-27H,1H3
InChIKey FETDAEUSVMWXCQ-UHFFFAOYSA-N
Mol Weight 459.51 g/mol
Molecular Formula C27H21N7O
Exact Mass 459.180758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Sr8N0mc1G7
Name 1,3-Bis(1,2,3-1H-benzotriazol-1-yl)-2-(p-methoxyphenyl)isoindoline
Alternate Name(s) 1-[3-(1H-1,2,3-benzotriazol-1-yl)-2-(4-methoxyphenyl)-2,3-dihydro-1H-isoindol-1-yl]-1H-1,2,3-benzotriazole 4-[1,3-di(1H-1,2,3-benzotriazol-1-yl)-1,3-dihydro-2H-isoindol-2-yl]phenyl methyl ether
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Formula C27H21N7O
InChI InChI=1S/C27H21N7O/c1-35-19-16-14-18(15-17-19)32-26(33-24-12-6-4-10-22(24)28-30-33)20-8-2-3-9-21(20)27(32)34-25-13-7-5-11-23(25)29-31-34/h2-17,26-27H,1H3
InChIKey FETDAEUSVMWXCQ-UHFFFAOYSA-N
Molecular Weight 459.513 g/mol
SMILES C1([n]2nnc3c2cccc3)N(C([n]2nnc3c2cccc3)c2c1cccc2)c1ccc(cc1)OC
SPLASH splash10-02t9-0957000000-55654d093f8a56812b2c
Source of Spectrum H1-43-81-4
Wiley ID 757698