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1-(2,3-dimethylphenyl)-4-(9H-xanthen-9-ylcarbonyl)piperazine
SpectraBase Compound ID 5CrJQUIRcRS
InChI InChI=1S/C26H26N2O2/c1-18-8-7-11-22(19(18)2)27-14-16-28(17-15-27)26(29)25-20-9-3-5-12-23(20)30-24-13-6-4-10-21(24)25/h3-13,25H,14-17H2,1-2H3
InChIKey PMRBPEUNOCUECL-UHFFFAOYSA-N
Mol Weight 398.51 g/mol
Molecular Formula C26H26N2O2
Exact Mass 398.199428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8RIn0yjTljq
Name 1-(2,3-Dimethylphenyl)-4-(9H-xanthen-9-ylcarbonyl)piperazine
Alternate Name(s) [4-(2,3-dimethylphenyl)-1-piperazinyl]-(9H-xanthen-9-yl)methanone [4-(2,3-dimethylphenyl)piperazin-1-yl]-(9H-xanthen-9-yl)methanone [4-(2,3-dimethylphenyl)piperazino]-(9H-xanthen-9-yl)methanone
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Formula C26H26N2O2
InChI InChI=1S/C26H26N2O2/c1-18-8-7-11-22(19(18)2)27-14-16-28(17-15-27)26(29)25-20-9-3-5-12-23(20)30-24-13-6-4-10-21(24)25/h3-13,25H,14-17H2,1-2H3
InChIKey PMRBPEUNOCUECL-UHFFFAOYSA-N
Molecular Weight 398.506 g/mol
SMILES c1ccc2c(Oc3c(C2C(N2CCN(CC2)c2cccc(c2C)C)=O)cccc3)c1
SPLASH splash10-001i-1900000000-a498b54812573dd64aff
Wiley ID 1442730