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5-N-Thiophthalimide-4-hydroxy[2.2]paracyclophane
SpectraBase Compound ID J24A9MSufO2
InChI InChI=1S/C24H19NO3S/c26-21-17-11-9-15-5-7-16(8-6-15)10-12-18(14-13-17)22(21)29-25-23(27)19-3-1-2-4-20(19)24(25)28/h1-8,13-14,26H,9-12H2
InChIKey PIBZKDMEWGEBLW-UHFFFAOYSA-N
Mol Weight 401.48 g/mol
Molecular Formula C24H19NO3S
Exact Mass 401.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Af0uxZwNPjX
Name 5-N-Thiophthalimide-4-hydroxy[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H19NO3S
InChI InChI=1S/C24H19NO3S/c26-21-17-11-9-15-5-7-16(8-6-15)10-12-18(14-13-17)22(21)29-25-23(27)19-3-1-2-4-20(19)24(25)28/h1-8,13-14,26H,9-12H2
InChIKey PIBZKDMEWGEBLW-UHFFFAOYSA-N
Molecular Weight 401.480 g/mol
SMILES Oc1c(SN2C(c3ccccc3C2=O)=O)c2ccc1CCc1ccc(CC2)cc1
SPLASH splash10-0udi-0940200000-70ce31dde293cd3a3295
Source of Spectrum F-62-5629-5
Wiley ID 1633534