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N,N'-Bis(9H-xanthenyl-9)-urea

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N,N'-Bis(9H-xanthenyl-9)-urea
SpectraBase Compound ID 2r5WbcDU7Cf
InChI InChI=1S/C27H20N2O3/c30-27(28-25-17-9-1-5-13-21(17)31-22-14-6-2-10-18(22)25)29-26-19-11-3-7-15-23(19)32-24-16-8-4-12-20(24)26/h1-16,25-26H,(H2,28,29,30)
InChIKey XWEYDSIYIFOLQK-UHFFFAOYSA-N
Mol Weight 420.47 g/mol
Molecular Formula C27H20N2O3
Exact Mass 420.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63QsNlVabWB
Name 1,3-bis(9H-xanthen-9-yl)urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H20N2O3
InChI InChI=1S/C27H20N2O3/c30-27(28-25-17-9-1-5-13-21(17)31-22-14-6-2-10-18(22)25)29-26-19-11-3-7-15-23(19)32-24-16-8-4-12-20(24)26/h1-16,25-26H,(H2,28,29,30)
InChIKey XWEYDSIYIFOLQK-UHFFFAOYSA-N
Molecular Weight 420.468 g/mol
SMILES N(C(NC1c2c(cccc2)Oc2c1cccc2)=O)C1c2c(cccc2)Oc2c1cccc2
SPLASH splash10-001i-1920000000-ec6b010c88651c9d904b
Source of Spectrum RB-1982-13897-0
Wiley ID 122393