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Zn-isonanamidine C

View entire compound with spectra: 1 MS (GC)

Zn-isonanamidine C
SpectraBase Compound ID 7IT6jLJiTVg
InChI InChI=1S/2C23H23N5O4.Zn/c2*1-27-21(29)20(26-23(27)30)25-22-24-17(12-15-4-8-18(31-2)9-5-15)14-28(22)13-16-6-10-19(32-3)11-7-16;/h2*4-11,14H,12-13H2,1-3H3,(H,24,25,26,30);/q;;+2/p-2
InChIKey ZKQDHDPKWYAOCJ-UHFFFAOYSA-L
Mol Weight 930.3 g/mol
Molecular Formula C46H44N10O8Zn
Exact Mass 928.2635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKdjk1XAqSD
Name Zn-isonanamidine C
Alternate Name(s) zinc;[1,4-bis[(4-methoxyphenyl)methyl]-2-imidazolyl]-(1-methyl-2,5-dioxo-4-imidazolyl)azanide zinc;[1,4-bis[(4-methoxyphenyl)methyl]imidazol-2-yl]-(1-methyl-2,5-dioxoimidazol-4-yl)azanide zinc;[1,4-bis[(4-methoxyphenyl)methyl]imidazol-2-yl]-(1-methyl-2,5-dioxo-imidazol-4-yl)azanide zinc;[1,4-bis[(4-methoxyphenyl)methyl]imidazol-2-yl]-[1-methyl-2,5-bis(oxidanylidene)imidazol-4-yl]azanide
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Formula C46H44N10O8Zn
InChI InChI=1S/2C23H23N5O4.Zn/c2*1-27-21(29)20(26-23(27)30)25-22-24-17(12-15-4-8-18(31-2)9-5-15)14-28(22)13-16-6-10-19(32-3)11-7-16;/h2*4-11,14H,12-13H2,1-3H3,(H,24,25,26,30);/q;;+2/p-2
InChIKey ZKQDHDPKWYAOCJ-UHFFFAOYSA-L
Molecular Weight 930.302 g/mol
SMILES C1(N(c2[n](cc(n2)Cc2ccc(cc2)OC)Cc2ccc(cc2)OC)[Zn]N(C2=NC(=O)N(C2=O)C)c2[n](cc(n2)Cc2ccc(cc2)OC)Cc2ccc(cc2)OC)=NC(=O)N(C1=O)C
SPLASH splash10-0259-0936600000-df747d29ca872a6cd0f3
Source of Spectrum F-49-333-12
Wiley ID 1418164