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3-{N-[4-(N'-Dimethylamino)phenyl]azo}-2-fluoro-5,12,15,22-tetrathiapentacyclo[12.8.0.0(4,13).0(6,11).0(16,21)]docosa-1,2,4,6,7,9,16,17,19-nonene
SpectraBase Compound ID LJpMLyxNbwq
InChI InChI=1S/C26H18FN3S4/c1-30(2)16-13-11-15(12-14-16)28-29-22-21(27)23-25(33-19-9-5-3-7-17(19)31-23)26-24(22)32-18-8-4-6-10-20(18)34-26/h3-14H,1-2H3/b29-28+
InChIKey DHLZZALZSMDCOP-ZQHSETAFSA-N
Mol Weight 519.7 g/mol
Molecular Formula C26H18FN3S4
Exact Mass 519.03676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ji7czQKpnJn
Name 3-{N-[4-(N'-Dimethylamino)phenyl]azo}-2-fluoro-5,12,15,22-tetrathiapentacyclo[12.8.0.0(4,13).0(6,11).0(16,21)]docosa-1,2,4,6,7,9,16,17,19-nonene
Comments Less than 3 mono-isotopic peaks
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Formula C26H18FN3S4
InChI InChI=1S/C26H18FN3S4/c1-30(2)16-13-11-15(12-14-16)28-29-22-21(27)23-25(33-19-9-5-3-7-17(19)31-23)26-24(22)32-18-8-4-6-10-20(18)34-26/h3-14H,1-2H3/b29-28+
InChIKey DHLZZALZSMDCOP-ZQHSETAFSA-N
Molecular Weight 519.689 g/mol
SMILES c12c3c(Sc4c(S3)cccc4)c(c(c2Sc2c(S1)cccc2)\N=N\c1ccc(cc1)N(C)C)F
SPLASH splash10-00di-0800090000-1b49aa335a53325cd0df
Source of Spectrum AJ-75-536-7
Wiley ID 1577014