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Methyl 6-t-Butyl-3-[di(2-pyrrolyl)methyl]-1-azulenecarboxylate
SpectraBase Compound ID J5HbpNWFqQP
InChI InChI=1S/C25H26N2O2/c1-25(2,3)16-9-11-17-18(12-10-16)20(24(28)29-4)15-19(17)23(21-7-5-13-26-21)22-8-6-14-27-22/h5-15,23,26-27H,1-4H3
InChIKey UTZPZGCCQHECSQ-UHFFFAOYSA-N
Mol Weight 386.5 g/mol
Molecular Formula C25H26N2O2
Exact Mass 386.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wnspc2PFA
Name Methyl 6-t-Butyl-3-[di(2-pyrrolyl)methyl]-1-azulenecarboxylate
Alternate Name(s) 3-[bis(1H-pyrrol-2-yl)methyl]-6-tert-butyl-1-azulenecarboxylic acid methyl ester 3-[bis(1H-pyrrol-2-yl)methyl]-6-tert-butyl-azulene-1-carboxylic acid methyl ester Methyl 3-[bis(1H-pyrrol-2-yl)methyl]-6-tert-butyl-azulene-1-carboxylate Methyl 6-tert-butyl-3-[di(1H-pyrrol-2-yl)methyl]-1-azulenecarboxylate
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Formula C25H26N2O2
InChI InChI=1S/C25H26N2O2/c1-25(2,3)16-9-11-17-18(12-10-16)20(24(28)29-4)15-19(17)23(21-7-5-13-26-21)22-8-6-14-27-22/h5-15,23,26-27H,1-4H3
InChIKey UTZPZGCCQHECSQ-UHFFFAOYSA-N
Molecular Weight 386.495 g/mol
SMILES [nH]1cccc1C(c1[nH]ccc1)c1c2c(ccc(cc2)C(C)(C)C)c(c1)C(=O)OC
SPLASH splash10-002f-2349000000-f7cb0a4810c16b01393d
Source of Spectrum AJ-72-2547-16
Wiley ID 775170