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10,11-(4',5'-Phthaloyl-4',5'-diazacyclohexano)[3.2]paracyclophan-10-ene

View entire compound with spectra: 2 MS (GC)

10,11-(4',5'-Phthaloyl-4',5'-diazacyclohexano)[3.2]paracyclophan-10-ene
SpectraBase Compound ID 4DgguEUxP4o
InChI InChI=1S/C27H22N2O2/c30-26-22-6-1-2-7-23(22)27(31)29-17-25-21-14-10-19(11-15-21)5-3-4-18-8-12-20(13-9-18)24(25)16-28(26)29/h1-2,6-15H,3-5,16-17H2
InChIKey PJHMULXOUYBGON-UHFFFAOYSA-N
Mol Weight 406.49 g/mol
Molecular Formula C27H22N2O2
Exact Mass 406.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0oX4rVdh32
Name 10,11-(4',5'-Phthaloyl-4',5'-diazacyclohexano)[3.2]paracyclophan-10-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N2O2
InChI InChI=1S/C27H22N2O2/c30-26-22-6-1-2-7-23(22)27(31)29-17-25-21-14-10-19(11-15-21)5-3-4-18-8-12-20(13-9-18)24(25)16-28(26)29/h1-2,6-15H,3-5,16-17H2
InChIKey PJHMULXOUYBGON-UHFFFAOYSA-N
Molecular Weight 406.485 g/mol
SMILES c1c2ccc(C3=C(CN4C(c5ccccc5C(N4C3)=O)=O)c3ccc(cc3)CCC2)c1
SPLASH splash10-0a4i-4950300000-4163fcb535daf2b6776f
Wiley ID 1476827